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Diazanaphthalenes

Organic heterocyclic compounds that consist of a naphthalene double ring in which two of the carbon atoms have been replaced with nitrogen atoms.
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1 – 15 of 19 results
1

2,4-Dichloro-6,7-dimethoxyquinazoline, TRC

CAS: 27631-29-4 Chemical Name or Material: 2,4-Dichloro-6,7-dimethoxyquinazoline Formula Weight: 257.9963 InChI Formula: InChI=1S/C10H8Cl2N2O2/c1-15-7-3-5-6(4-8(7)16-2)13-10(12)14-9(5)11/h3-4H,1-2H3 IUPAC Name: 2,4-dichloro-6,7-dimethoxyquinazoline Molecular Formula: C10 H8 Cl2 N2 O2 Molecular Weight (g/mol): 259.09 Recommended Storage: 4°C SMILES: COc1cc2nc(Cl)nc(Cl)c2cc1OC Synonym: 2,4-Dichloro-6,7-dimethoxyquinazoline,Doxazosin Mesilate Imp. E (EP)

CAS 27631-29-4
Molecular Weight (g/mol) 259.09
InChI Formula InChI=1S/C10H8Cl2N2O2/c1-15-7-3-5-6(4-8(7)16-2)13-10(12)14-9(5)11/h3-4H,1-2H3
Chemical Name or Material 2,4-Dichloro-6,7-dimethoxyquinazoline
Synonym 2,4-Dichloro-6,7-dimethoxyquinazoline,Doxazosin Mesilate Imp. E (EP)
SMILES COc1cc2nc(Cl)nc(Cl)c2cc1OC
Recommended Storage 4°C
Molecular Formula C10 H8 Cl2 N2 O2
IUPAC Name 2,4-dichloro-6,7-dimethoxyquinazoline
Formula Weight 257.9963
2

Carbadox (Technical Grade), TRC

CAS: 6804-07-5 Chemical Name or Material: Carbadox Formula Weight: 262.0702 InChI Formula: InChI=1S/C11H10N4O4/c1-19-11(16)13-12-6-8-7-14(17)9-4-2-3-5-10(9)15(8)18/h2-7H,1H3,(H,13,16)/b12-6+ IUPAC Name: methyl N-[(E)-(1,4-dioxidoquinoxaline-1,4-diium-2-yl)methylideneamino]carbamate Molecular Formula: C11 H10 N4 O4 Molecular Weight (g/mol): 262.22 Recommended Storage: -20°C SMILES: COC(=O)N\N=C\c1c[n+]([O-])c2ccccc2[n+]1[O-] Synonym: Carbazic acid, 3-(2-quinoxalinylmethylene)-, methyl ester, N,N'-dioxide (7CI),Carbazic acid, 3-(2-quinoxalinylmethylene)-, methyl ester, N1,N4-dioxide (8CI),Hydrazinecarboxylic acid, (2-quinoxalinylmethylene)-, methyl ester, N,N'-dioxide,Hydrazinecarboxylic acid, [(1,4-dioxido-2-quinoxalinyl)methylene]-, methyl ester (9CI),2-Formylquinoxaline-1,4-dioxide carbomethoxyhydrazone,Carbadox,Fortigro,GS 6244,Getroxel,Mecadox,Methyl 3-(2-quinoxalinylmethylene)carbazate N1,N4-dioxide,Quinoxaline-2-carbomethoxyhydrazone 1,4-dioxide

CAS 6804-07-5
Molecular Weight (g/mol) 262.22
InChI Formula InChI=1S/C11H10N4O4/c1-19-11(16)13-12-6-8-7-14(17)9-4-2-3-5-10(9)15(8)18/h2-7H,1H3,(H,13,16)/b12-6+
Chemical Name or Material Carbadox
Synonym Carbazic acid, 3-(2-quinoxalinylmethylene)-, methyl ester, N,N'-dioxide (7CI),Carbazic acid, 3-(2-quinoxalinylmethylene)-, methyl ester, N1,N4-dioxide (8CI),Hydrazinecarboxylic acid, (2-quinoxalinylmethylene)-, methyl ester, N,N'-dioxide,Hydrazinecarboxylic acid, [(1,4-dioxido-2-quinoxalinyl)methylene]-, methyl ester (9CI),2-Formylquinoxaline-1,4-dioxide carbomethoxyhydrazone,Carbadox,Fortigro,GS 6244,Getroxel,Mecadox,Methyl 3-(2-quinoxalinylmethylene)carbazate N1,N4-dioxide,Quinoxaline-2-carbomethoxyhydrazone 1,4-dioxide
SMILES COC(=O)N\N=C\c1c[n+]([O-])c2ccccc2[n+]1[O-]
Recommended Storage -20°C
Molecular Formula C11 H10 N4 O4
IUPAC Name methyl N-[(E)-(1,4-dioxidoquinoxaline-1,4-diium-2-yl)methylideneamino]carbamate
Formula Weight 262.0702
3

N-Desmethyl Azelastine, TRC

CAS: 47491-38-3 Chemical Name or Material: N-Desmethyl Azelastine Formula Weight: 367.1451 InChI Formula: InChI=1S/C21H22ClN3O/c22-16-9-7-15(8-10-16)14-20-18-5-1-2-6-19(18)21(26)25(24-20)17-4-3-12-23-13-11-17/h1-2,5-10,17,23H,3-4,11-14H2 IUPAC Name: 2-(azepan-4-yl)-4-[(4-chlorophenyl)methyl]phthalazin-1-one Molecular Formula: C21 H22 Cl N3 O Molecular Weight (g/mol): 367.87 Recommended Storage: 4°C SMILES: Clc1ccc(CC2=NN(C3CCCNCC3)C(=O)c4ccccc24)cc1 Synonym: 1(2H)-Phthalazinone, 4-[(4-chlorophenyl)methyl]-2-(hexahydro-1H-azepin-4-yl)-,4-[(4-Chlorophenyl)methyl]-2-(hexahydro-1H-azepin-4-yl)-1(2H)-phthalazinone,Demethylazelastine,Desmethylazelastine,N-Desmethyl Azelastine,N-Desmethylazelastine

CAS 47491-38-3
Molecular Weight (g/mol) 367.87
InChI Formula InChI=1S/C21H22ClN3O/c22-16-9-7-15(8-10-16)14-20-18-5-1-2-6-19(18)21(26)25(24-20)17-4-3-12-23-13-11-17/h1-2,5-10,17,23H,3-4,11-14H2
Chemical Name or Material N-Desmethyl Azelastine
Synonym 1(2H)-Phthalazinone, 4-[(4-chlorophenyl)methyl]-2-(hexahydro-1H-azepin-4-yl)-,4-[(4-Chlorophenyl)methyl]-2-(hexahydro-1H-azepin-4-yl)-1(2H)-phthalazinone,Demethylazelastine,Desmethylazelastine,N-Desmethyl Azelastine,N-Desmethylazelastine
SMILES Clc1ccc(CC2=NN(C3CCCNCC3)C(=O)c4ccccc24)cc1
Recommended Storage 4°C
Molecular Formula C21 H22 Cl N3 O
IUPAC Name 2-(azepan-4-yl)-4-[(4-chlorophenyl)methyl]phthalazin-1-one
Formula Weight 367.1451
4

Erastin, TRC

CAS: 571203-78-6 Chemical Name or Material: Erastin Formula Weight: 546.2 InChI Formula: InChI=1S/C30H31ClN4O4/c1-3-38-27-11-7-6-10-26(27)35-29(32-25-9-5-4-8-24(25)30(35)37)21(2)33-16-18-34(19-17-33)28(36)20-39-23-14-12-22(31)13-15-23/h4-15,21H,3,16-20H2,1-2H3 IUPAC Name: 2-(1-(4-(2-(4-chlorophenoxy)acetyl)piperazin-1-yl)ethyl)-3-(2-ethoxyphenyl)quinazolin-4(3H)-one Molecular Formula: C30H31ClN4O4 Molecular Weight (g/mol): 547.04 Recommended Storage: 4°C SMILES: O=C1N(C2=CC=CC=C2OCC)C(C(N3CCN(C(COC4=CC=C(Cl)C=C4)=O)CC3)C)=NC5=C1C=CC=C5 Synonym: 2-[1-[4-[2-(4-Chlorophenoxy)acetyl]-1-piperazinyl]ethyl]-3-(2-ethoxyphenyl)-4(3H)-quinazolinone

CAS 571203-78-6
Molecular Weight (g/mol) 547.04
InChI Formula InChI=1S/C30H31ClN4O4/c1-3-38-27-11-7-6-10-26(27)35-29(32-25-9-5-4-8-24(25)30(35)37)21(2)33-16-18-34(19-17-33)28(36)20-39-23-14-12-22(31)13-15-23/h4-15,21H,3,16-20H2,1-2H3
Chemical Name or Material Erastin
Synonym 2-[1-[4-[2-(4-Chlorophenoxy)acetyl]-1-piperazinyl]ethyl]-3-(2-ethoxyphenyl)-4(3H)-quinazolinone
SMILES O=C1N(C2=CC=CC=C2OCC)C(C(N3CCN(C(COC4=CC=C(Cl)C=C4)=O)CC3)C)=NC5=C1C=CC=C5
Recommended Storage 4°C
Molecular Formula C30H31ClN4O4
IUPAC Name 2-(1-(4-(2-(4-chlorophenoxy)acetyl)piperazin-1-yl)ethyl)-3-(2-ethoxyphenyl)quinazolin-4(3H)-one
Formula Weight 546.2
5

Enoxacin Sesquihydrate, TRC

CAS: 84294-96-2 Chemical Name or Material: Enoxacin sesquihydrate Formula Weight: 694.2886 InChI Formula: InChI=1S/2C15H17FN4O3.3H2O/c2*1-2-19-8-10(15(22)23)12(21)9-7-11(16)14(18-13(9)19)20-5-3-17-4-6-20;;;/h2*7-8,17H,2-6H2,1H3,(H,22,23);3*1H2 IUPAC Name: 1-ethyl-6-fluoro-4-oxo-7-piperazin-1-yl-1,8-naphthyridine-3-carboxylic acid;trihydrate Molecular Formula: 2 C15 H17 F N4 O3 . 3 H2 O Molecular Weight (g/mol): 694.68 Recommended Storage: -20°C SMILES: O.O.O.CCN1C=C(C(=O)O)C(=O)c2cc(F)c(nc12)N3CCNCC3.CCN4C=C(C(=O)O)C(=O)c5cc(F)c(nc45)N6CCNCC6 Synonym: 1-Ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-1,8-Naphthyridine-3-carboxylic Acid Hydrate (2:3),Enoxacin Sesquihydrate,1,8-Naphthyridine-3-carboxylic acid, 1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-, hydrate (2:3) (9CI, ACI)

CAS 84294-96-2
Molecular Weight (g/mol) 694.68
InChI Formula InChI=1S/2C15H17FN4O3.3H2O/c2*1-2-19-8-10(15(22)23)12(21)9-7-11(16)14(18-13(9)19)20-5-3-17-4-6-20;;;/h2*7-8,17H,2-6H2,1H3,(H,22,23);3*1H2
Chemical Name or Material Enoxacin sesquihydrate
Synonym 1-Ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-1,8-Naphthyridine-3-carboxylic Acid Hydrate (2:3),Enoxacin Sesquihydrate,1,8-Naphthyridine-3-carboxylic acid, 1-ethyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl)-, hydrate (2:3) (9CI, ACI)
SMILES O.O.O.CCN1C=C(C(=O)O)C(=O)c2cc(F)c(nc12)N3CCNCC3.CCN4C=C(C(=O)O)C(=O)c5cc(F)c(nc45)N6CCNCC6
Recommended Storage -20°C
Molecular Formula 2 C15 H17 F N4 O3 . 3 H2 O
IUPAC Name 1-ethyl-6-fluoro-4-oxo-7-piperazin-1-yl-1,8-naphthyridine-3-carboxylic acid;trihydrate
Formula Weight 694.2886
6

7-Chloro-6-fluoro-1-(2,4-difluorophenyl)-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic Acid Ethyl Ester, TRC

CAS: 100491-29-0 Chemical Name or Material: 7-Chloro-6-fluoro-1-(2,4-difluorophenyl)-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic Acid Ethyl Ester Formula Weight: 382.0332 InChI Formula: InChI=1S/C17H10ClF3N2O3/c1-2-26-17(25)10-7-23(13-4-3-8(19)5-11(13)20)16-9(14(10)24)6-12(21)15(18)22-16/h3-7H,2H2,1H3 IUPAC Name: ethyl 7-chloro-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylate Molecular Formula: C17H10ClF3N2O3 Molecular Weight (g/mol): 382.72 Recommended Storage: 4°C SMILES: CCOC(=O)C1=CN(c2ccc(F)cc2F)c3nc(Cl)c(F)cc3C1=O Synonym: 7-Chloro-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic Acid Ethyl Ester,Ethyl 1-(2,4-Difluorophenyl)-7-chloro-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylate

CAS 100491-29-0
Molecular Weight (g/mol) 382.72
InChI Formula InChI=1S/C17H10ClF3N2O3/c1-2-26-17(25)10-7-23(13-4-3-8(19)5-11(13)20)16-9(14(10)24)6-12(21)15(18)22-16/h3-7H,2H2,1H3
Chemical Name or Material 7-Chloro-6-fluoro-1-(2,4-difluorophenyl)-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic Acid Ethyl Ester
Synonym 7-Chloro-1-(2,4-difluorophenyl)-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylic Acid Ethyl Ester,Ethyl 1-(2,4-Difluorophenyl)-7-chloro-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylate
SMILES CCOC(=O)C1=CN(c2ccc(F)cc2F)c3nc(Cl)c(F)cc3C1=O
Recommended Storage 4°C
Molecular Formula C17H10ClF3N2O3
IUPAC Name ethyl 7-chloro-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylate
Formula Weight 382.0332
7

4-Chloro-6-iodoquinazoline, TRC

CAS: 98556-31-1 Chemical Name or Material: 4-Chloro-6-iodoquinazoline Formula Weight: 289.9108 InChI Formula: InChI=1S/C8H4ClIN2/c9-8-6-3-5(10)1-2-7(6)11-4-12-8/h1-4H IUPAC Name: 4-chloro-6-iodoquinazoline Molecular Formula: C8H4ClIN2 Molecular Weight (g/mol): 290.49 Recommended Storage: -20°C SMILES: Clc1ncnc2ccc(I)cc12 Synonym: 6-Iodo-4-chloroquinazoline

CAS 98556-31-1
Molecular Weight (g/mol) 290.49
InChI Formula InChI=1S/C8H4ClIN2/c9-8-6-3-5(10)1-2-7(6)11-4-12-8/h1-4H
Chemical Name or Material 4-Chloro-6-iodoquinazoline
Synonym 6-Iodo-4-chloroquinazoline
SMILES Clc1ncnc2ccc(I)cc12
Recommended Storage -20°C
Molecular Formula C8H4ClIN2
IUPAC Name 4-chloro-6-iodoquinazoline
Formula Weight 289.9108
8

6,7-Dimethoxyquinazoline-2,4-dione, TRC

CAS: 28888-44-0 Chemical Name or Material: 6,7-dimethoxyquinazoline-2,4(1H,3H)-dione Formula Weight: 222.0641 InChI Formula: InChI=1S/C10H10N2O4/c1-15-7-3-5-6(4-8(7)16-2)11-10(14)12-9(5)13/h3-4H,1-2H3,(H2,11,12,13,14) IUPAC Name: 6,7-dimethoxy-1H-quinazoline-2,4-dione Molecular Formula: C10 H10 N2 O4 Molecular Weight (g/mol): 222.2 Recommended Storage: 4°C SMILES: COc1cc2NC(=O)NC(=O)c2cc1OC Synonym: 6,7-Dimethoxyquinazoline-2,4(1H,3H)-dione,Doxazosin Mesilate Imp. D (EP),2,4(1H,3H)-Quinazolinedione, 6,7-dimethoxy-,6,7-Dimethoxy-2,4(1H,3H)-quinazolinedione,2,5-Dihydroxy-6,7-dimethoxyquinazoline,6,7-Dimethoxy-1H-quinazoline-2,4-dione,6,7-Dimethoxyquinazoline-2,4-diol,6,7-Dimethoxyquinazoline-2,4-dione

CAS 28888-44-0
Molecular Weight (g/mol) 222.2
InChI Formula InChI=1S/C10H10N2O4/c1-15-7-3-5-6(4-8(7)16-2)11-10(14)12-9(5)13/h3-4H,1-2H3,(H2,11,12,13,14)
Chemical Name or Material 6,7-dimethoxyquinazoline-2,4(1H,3H)-dione
Synonym 6,7-Dimethoxyquinazoline-2,4(1H,3H)-dione,Doxazosin Mesilate Imp. D (EP),2,4(1H,3H)-Quinazolinedione, 6,7-dimethoxy-,6,7-Dimethoxy-2,4(1H,3H)-quinazolinedione,2,5-Dihydroxy-6,7-dimethoxyquinazoline,6,7-Dimethoxy-1H-quinazoline-2,4-dione,6,7-Dimethoxyquinazoline-2,4-diol,6,7-Dimethoxyquinazoline-2,4-dione
SMILES COc1cc2NC(=O)NC(=O)c2cc1OC
Recommended Storage 4°C
Molecular Formula C10 H10 N2 O4
IUPAC Name 6,7-dimethoxy-1H-quinazoline-2,4-dione
Formula Weight 222.0641
9

6-Iodoquinazolin-4-one, TRC

CAS: 16064-08-7 Chemical Name or Material: 6-Iodoquinazolin-4-one Formula Weight: 271.9447 InChI Formula: InChI=1S/C8H5IN2O/c9-5-1-2-7-6(3-5)8(12)11-4-10-7/h1-4H,(H,10,11,12) Molecular Formula: C8H5IN2O Molecular Weight (g/mol): 272.05 Recommended Storage: 4°C SMILES: Ic1ccc2NC=NC(=O)c2c1 Synonym: 6-Iodo-4(3H)-quinazolinone,6-Iodo-4(1H)-quinazolinone,6-Iodo-4-quinazolinol,6-Iodo-1H-quinazolin-4-one,6-Iodo-3,4-dihydroquinazolin-4-one,6-Iodo-3H-quinazolin-4-one,6-Iodo-4(3H)-quinazolinone,6-Iodo-4-quinazolone,6-Iodoquinazolin-4-ol

CAS 16064-08-7
Molecular Weight (g/mol) 272.05
InChI Formula InChI=1S/C8H5IN2O/c9-5-1-2-7-6(3-5)8(12)11-4-10-7/h1-4H,(H,10,11,12)
Chemical Name or Material 6-Iodoquinazolin-4-one
Synonym 6-Iodo-4(3H)-quinazolinone,6-Iodo-4(1H)-quinazolinone,6-Iodo-4-quinazolinol,6-Iodo-1H-quinazolin-4-one,6-Iodo-3,4-dihydroquinazolin-4-one,6-Iodo-3H-quinazolin-4-one,6-Iodo-4(3H)-quinazolinone,6-Iodo-4-quinazolone,6-Iodoquinazolin-4-ol
SMILES Ic1ccc2NC=NC(=O)c2c1
Recommended Storage 4°C
Molecular Formula C8H5IN2O
Formula Weight 271.9447
10

N-De[2-(methylsulfonyl)ethyl] Lapatinib, TRC

CAS: 697299-82-4 Chemical Name or Material: N-De[2-(methylsulfonyl)ethyl] Lapatinib InChI Formula: InChI=1S/C26H20ClFN4O2/c27-22-12-19(5-8-25(22)33-14-16-2-1-3-18(28)10-16)32-26-21-11-17(4-7-23(21)30-15-31-26)24-9-6-20(13-29)34-24/h1-12,15H,13-14,29H2,(H,30,31,32) Molecular Formula: C26H20ClFN4O2 Molecular Weight (g/mol): 474.91 Recommended Storage: -20°C SMILES: Cc1nc2c3c(ccc2nc1)n(C)c(N)n3 Synonym: 6-[5-(Aminomethyl)-2-furanyl]-N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-4-quinazolinamine,[6-(5-Aminomethylfuran-2-yl)quinazolin-4-yl][3-chloro- 4-(3-fluorobenzyloxy)phenyl]amine

CAS 697299-82-4
Molecular Weight (g/mol) 474.91
InChI Formula InChI=1S/C26H20ClFN4O2/c27-22-12-19(5-8-25(22)33-14-16-2-1-3-18(28)10-16)32-26-21-11-17(4-7-23(21)30-15-31-26)24-9-6-20(13-29)34-24/h1-12,15H,13-14,29H2,(H,30,31,32)
Chemical Name or Material N-De[2-(methylsulfonyl)ethyl] Lapatinib
Synonym 6-[5-(Aminomethyl)-2-furanyl]-N-[3-chloro-4-[(3-fluorophenyl)methoxy]phenyl]-4-quinazolinamine,[6-(5-Aminomethylfuran-2-yl)quinazolin-4-yl][3-chloro- 4-(3-fluorobenzyloxy)phenyl]amine
SMILES Cc1nc2c3c(ccc2nc1)n(C)c(N)n3
Recommended Storage -20°C
Molecular Formula C26H20ClFN4O2
11

CGS-12066A Maleate Salt, TRC

CAS: 1350965-83-1 Chemical Name or Material: 4-(4-Methyl-1-piperazinyl)-7-(trifluoromethyl)-pyrrolo[1,2-a]quinoxaline (2Z)-2-Butenedioate Formula Weight: 450.1515 InChI Formula: InChI=1S/C17H17F3N4.C4H4O4/c1-22-7-9-23(10-8-22)16-15-3-2-6-24(15)14-5-4-12(17(18,19)20)11-13(14)21-16;5-3(6)1-2-4(7)8/h2-6,11H,7-10H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1- IUPAC Name: (Z)-but-2-enedioic acid;4-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline Molecular Formula: C17H17F3N4 . C4H4O4 Molecular Weight (g/mol): 450.4 Recommended Storage: -20°C SMILES: CN1CCN(CC1)c2nc3cc(ccc3n4cccc24)C(F)(F)F.OC(=O)\C=C/C(=O)O Synonym: CGS-12066A Maleate Salt,4-(4-Methyl-1-piperazinyl)-7-(trifluoromethyl)-pyrrolo[1,2-a]quinoxaline (2Z)-2-Butenedioate

CAS 1350965-83-1
Molecular Weight (g/mol) 450.4
InChI Formula InChI=1S/C17H17F3N4.C4H4O4/c1-22-7-9-23(10-8-22)16-15-3-2-6-24(15)14-5-4-12(17(18,19)20)11-13(14)21-16;5-3(6)1-2-4(7)8/h2-6,11H,7-10H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
Chemical Name or Material 4-(4-Methyl-1-piperazinyl)-7-(trifluoromethyl)-pyrrolo[1,2-a]quinoxaline (2Z)-2-Butenedioate
Synonym CGS-12066A Maleate Salt,4-(4-Methyl-1-piperazinyl)-7-(trifluoromethyl)-pyrrolo[1,2-a]quinoxaline (2Z)-2-Butenedioate
SMILES CN1CCN(CC1)c2nc3cc(ccc3n4cccc24)C(F)(F)F.OC(=O)\C=C/C(=O)O
Recommended Storage -20°C
Molecular Formula C17H17F3N4 . C4H4O4
IUPAC Name (Z)-but-2-enedioic acid;4-(4-methylpiperazin-1-yl)-7-(trifluoromethyl)pyrrolo[1,2-a]quinoxaline
Formula Weight 450.1515
12

Dacomitinib, TRC

CAS: 1110813-31-4 Chemical Name or Material: Dacomitinib Formula Weight: 469.1681 InChI Formula: InChI=1S/C24H25ClFN5O2/c1-33-22-14-20-17(24(28-15-27-20)29-16-7-8-19(26)18(25)12-16)13-21(22)30-23(32)6-5-11-31-9-3-2-4-10-31/h5-8,12-15H,2-4,9-11H2,1H3,(H,30,32)(H,27,28,29)/b6-5+ IUPAC Name: (E)-N-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]-4-piperidin-1-ylbut-2-enamide Molecular Formula: C24 H25 Cl F N5 O2 Molecular Weight (g/mol): 469.94 Recommended Storage: 4°C SMILES: COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN4CCCCC4 Synonym: 2-Butenamide, N-[4-[(3-chloro-4-fluorophenyl)amino]-7-methoxy-6-quinazolinyl]-4-(1-piperidinyl)-, (2E)-,(2E)-N-[4-[(3-Chloro-4-fluorophenyl)amino]-7-methoxy-6-quinazolinyl]-4-(1-piperidinyl)-2-butenamide,Dacomitinib,PF 00299804,PF 299,PF 299804

CAS 1110813-31-4
Molecular Weight (g/mol) 469.94
InChI Formula InChI=1S/C24H25ClFN5O2/c1-33-22-14-20-17(24(28-15-27-20)29-16-7-8-19(26)18(25)12-16)13-21(22)30-23(32)6-5-11-31-9-3-2-4-10-31/h5-8,12-15H,2-4,9-11H2,1H3,(H,30,32)(H,27,28,29)/b6-5+
Chemical Name or Material Dacomitinib
Synonym 2-Butenamide, N-[4-[(3-chloro-4-fluorophenyl)amino]-7-methoxy-6-quinazolinyl]-4-(1-piperidinyl)-, (2E)-,(2E)-N-[4-[(3-Chloro-4-fluorophenyl)amino]-7-methoxy-6-quinazolinyl]-4-(1-piperidinyl)-2-butenamide,Dacomitinib,PF 00299804,PF 299,PF 299804
SMILES COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN4CCCCC4
Recommended Storage 4°C
Molecular Formula C24 H25 Cl F N5 O2
IUPAC Name (E)-N-[4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl]-4-piperidin-1-ylbut-2-enamide
Formula Weight 469.1681
14

Endophenazine A, TRC

CAS: 86125-71-5 Chemical Name or Material: Endophenazine A Formula Weight: 292.1212 InChI Formula: InChI=1S/C18H16N2O2/c1-11(2)9-10-12-5-3-7-14-16(12)20-17-13(18(21)22)6-4-8-15(17)19-14/h3-9H,10H2,1-2H3,(H,21,22) IUPAC Name: 9-(3-methylbut-2-enyl)phenazine-1-carboxylic acid Molecular Formula: C18H16N2O2 Molecular Weight (g/mol): 292.33 Recommended Storage: -20°C SMILES: CC(=CCc1cccc2nc3cccc(C(=O)O)c3nc12)C Synonym: 9-(3-Methyl-2-buten-1-yl)-1-phenazinecarboxylic Acid,9-(3-Methyl-2-butenyl)-1-phenazinecarboxylic Acid

CAS 86125-71-5
Molecular Weight (g/mol) 292.33
InChI Formula InChI=1S/C18H16N2O2/c1-11(2)9-10-12-5-3-7-14-16(12)20-17-13(18(21)22)6-4-8-15(17)19-14/h3-9H,10H2,1-2H3,(H,21,22)
Chemical Name or Material Endophenazine A
Synonym 9-(3-Methyl-2-buten-1-yl)-1-phenazinecarboxylic Acid,9-(3-Methyl-2-butenyl)-1-phenazinecarboxylic Acid
SMILES CC(=CCc1cccc2nc3cccc(C(=O)O)c3nc12)C
Recommended Storage -20°C
Molecular Formula C18H16N2O2
IUPAC Name 9-(3-methylbut-2-enyl)phenazine-1-carboxylic acid
Formula Weight 292.1212