6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole

C180H122N20S — CID 160719060

IUPAC6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole
SMILESC=C/C=C\c1cncc(-c2ccc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)cc2)c1.C=C/C=C\c1cnnc(-n2c3ccccc3c3c4ccn(-c5ccccc5)c4ccc32)c1.c1ccc(-c2cc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)cnn2)cc1.c1ccc(-c2cnc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)cn2)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5cc6ccccc6s5)c4ccc32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5cncc6ccccc56)c4ccc32)cc1
InChIInChI=1S/C35H25N3.2C30H20N4.C29H19N3.C28H20N4.C28H18N2S/c1-2-3-9-25-22-27(24-36-23-25)26-14-16-29(17-15-26)38-33-13-8-7-12-30(33)35-31-20-21-37(28-10-5-4-6-11-28)32(31)18-19-34(35)38;1-3-9-21(10-4-1)26-19-23(20-31-32-26)34-28-14-8-7-13-24(28)30-25-17-18-33(22-11-5-2-6-12-22)27(25)15-16-29(30)34;1-3-9-21(10-4-1)25-19-32-29(20-31-25)34-27-14-8-7-13-23(27)30-24-17-18-33(22-11-5-2-6-12-22)26(24)15-16-28(30)34;1-2-9-21(10-3-1)31-17-16-24-25(31)14-15-27-29(24)23-12-6-7-13-26(23)32(27)28-19-30-18-20-8-4-5-11-22(20)28;1-2-3-9-20-18-27(30-29-19-20)32-25-13-8-7-12-22(25)28-23-16-17-31(21-10-5-4-6-11-21)24(23)14-15-26(28)32;1-2-9-20(10-3-1)29-17-16-22-23(29)14-15-25-28(22)21-11-5-6-12-24(21)30(25)27-18-19-8-4-7-13-26(19)31-27/h2-24H,1H2;2*1-20H;1-19H;2-19H,1H2;1-18H/b9-3-;;;;9-3-;
InChIKeyRSVZFZQUIPAAHS-LFOPCZRCSA-N
MW2597.16 g/mol
LogP45.29
Rot. Bonds19

About 6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole

6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole (PubChem CID 160719060) has the molecular formula C180H122N20S and a molecular weight of 2597.16 g/mol. Its IUPAC name is 6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole.

Molecular Properties

Compound Name6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole
PubChem CID160719060
Molecular FormulaC180H122N20S
Molecular Weight2597.16 g/mol
Exact Mass2594.99
IUPAC Name6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole
SMILESC=C/C=C\c1cncc(-c2ccc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)cc2)c1.C=C/C=C\c1cnnc(-n2c3ccccc3c3c4ccn(-c5ccccc5)c4ccc32)c1.c1ccc(-c2cc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)cnn2)cc1.c1ccc(-c2cnc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)cn2)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5cc6ccccc6s5)c4ccc32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5cncc6ccccc56)c4ccc32)cc1
InChIInChI=1S/C35H25N3.2C30H20N4.C29H19N3.C28H20N4.C28H18N2S/c1-2-3-9-25-22-27(24-36-23-25)26-14-16-29(17-15-26)38-33-13-8-7-12-30(33)35-31-20-21-37(28-10-5-4-6-11-28)32(31)18-19-34(35)38;1-3-9-21(10-4-1)26-19-23(20-31-32-26)34-28-14-8-7-13-24(28)30-25-17-18-33(22-11-5-2-6-12-22)27(25)15-16-29(30)34;1-3-9-21(10-4-1)25-19-32-29(20-31-25)34-27-14-8-7-13-23(27)30-24-17-18-33(22-11-5-2-6-12-22)26(24)15-16-28(30)34;1-2-9-21(10-3-1)31-17-16-24-25(31)14-15-27-29(24)23-12-6-7-13-26(23)32(27)28-19-30-18-20-8-4-5-11-22(20)28;1-2-3-9-20-18-27(30-29-19-20)32-25-13-8-7-12-22(25)28-23-16-17-31(21-10-5-4-6-11-21)24(23)14-15-26(28)32;1-2-9-20(10-3-1)29-17-16-22-23(29)14-15-25-28(22)21-11-5-6-12-24(21)30(25)27-18-19-8-4-7-13-26(19)31-27/h2-24H,1H2;2*1-20H;1-19H;2-19H,1H2;1-18H/b9-3-;;;;9-3-;
InChIKeyRSVZFZQUIPAAHS-LFOPCZRCSA-N
XLogP45.29
TPSA162.28 Ų
H-Bond Donors
H-Bond Acceptors21
Rotatable Bonds19
Heavy Atoms201
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002597.16
LogP ≤ 545.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1021

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze 6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole with MolForge

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Related Compounds

1-(1-benzothiophen-2-yl)-6-propan-2-yl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;bis(1-(1H-inden-5-yl)-6-propan-2-yl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine);1-(3H-inden-1-yl)-6-propan-2-yl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;1-(1H-indol-2-yl)-6-propan-2-yl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;1-naphthalen-2-yl-6-propan-2-yl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;1-phenyl-6-propan-2-yl-3-(trifluoromethyl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine
CID 157230457
2,3-Diphenylindazole;1-fluoro-2-phenylimidazo[1,2-a]quinoline;2-[2-fluoro-4-(trifluoromethyl)phenyl]pyridine;2-naphthalen-2-ylimidazo[1,2-a]pyridine;2-phenyl-1,3-benzothiazole;2-phenylimidazo[1,2-a]pyridine;1-phenylindazole;2-phenylindazole;1-phenylisoquinoline;3-phenylisoquinoline;2-phenylpyrazolo[1,5-a]pyridine;2-phenylpyridine;2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyridine;2-thiophen-2-ylpyridine
CID 157653295
2-(3-tert-butylpyrazol-1-id-5-yl)-1-methylpyridin-1-ium;tris(2-(2H-dibenzothiophen-2-id-3-yl)quinoline);tris(iridium);1-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridin-1-ium;1-methyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridin-1-ium
CID 157842553
2,3-Diphenylindazole;1-fluoro-2-phenylimidazo[1,2-a]quinoline;2-[2-fluoro-4-(trifluoromethyl)phenyl]pyridine;2-phenyl-1,3-benzothiazole;2-phenylimidazo[1,2-a]pyridine;1-phenylindazole;2-phenylindazole;1-phenylisoquinoline;3-phenylisoquinoline;2-phenylpyrazolo[1,5-a]pyridine;2-phenylpyridine;2-phenyl-3-(trifluoromethyl)imidazo[1,2-a]pyridine;2-thiophen-2-ylpyridine
CID 158435881
2-(3-methyl-5H-pyrazol-5-id-1-yl)-3-(3-methylpyrazol-1-yl)-6-[2-[6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-5-[3-(trifluoromethyl)pyrazol-1-yl]-2-pyridinyl]propan-2-yl]pyridine;6-(3-methyl-5H-pyrazol-5-id-1-yl)-N-phenyl-5-pyridin-4-yl-N-[5-pyridin-4-yl-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;6-(3-methyl-5H-pyrazol-5-id-1-yl)-N-phenyl-5-(3H-pyrrol-2-yl)-N-[5-(3H-pyrrol-2-yl)-6-[3-(trifluoromethyl)-5H-pyrazol-5-id-1-yl]-2-pyridinyl]pyridin-2-amine;N-phenyl-5-pyrazin-2-yl-N-[5-pyrazin-2-yl-6-(3H-pyrazol-3-id-2-yl)-2-pyridinyl]-6-(3H-pyrazol-3-id-2-yl)pyridin-2-amine;pentakis(platinum(2+));2-(3H-pyrazol-3-id-2-yl)-6-[2-[6-(3H-pyrazol-3-id-2-yl)-5-thiophen-2-yl-2-pyridinyl]propan-2-yl]-3-thiophen-2-ylpyridine
CID 158856910
tris(3-(3H-dibenzothiophen-3-id-2-yl)pyrido[2,3-b]pyrazine);tris(iridium);1-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridin-1-ium;1-methyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridin-1-ium;1-methyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-1-ium
CID 158864873
2-[2-(4-chloro-7-methylpyrazolo[1,5-a]pyridin-2-yl)ethyl]-3-methylbenzo[e]benzimidazole;2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-3-methylbenzo[e]benzimidazole;2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-3-methylimidazo[4,5-h]quinoline;4-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-5-methyl-7-thia-3,5,12-triazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),3,9,11-pentaene;2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-3H-pyrrolo[3,2-h]quinoline;2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-[1,2,4]triazolo[5,1-a]isoquinoline;methane;3-methyl-2-[2-[7-methyl-4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]ethyl]benzo[e]benzimidazole
CID 158970318
tris(2-(2H-dibenzothiophen-2-id-3-yl)-4-methylquinoline);tris(iridium);1-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridin-1-ium;1-methyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridin-1-ium;1-methyl-2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridin-1-ium
CID 159027193
2-(3-tert-butylpyrazol-1-id-5-yl)-1-methylpyridin-1-ium;tris(6-(3H-dibenzothiophen-3-id-2-yl)pyrido[2,3-b]pyrazine);tris(iridium);1-methyl-2-(5-methylpyrazol-2-id-3-yl)pyridin-1-ium;1-methyl-2-[5-(trifluoromethyl)-1,4-diaza-2-azanidacyclopenta-3,5-dien-3-yl]pyridin-1-ium
CID 159232217
5-tert-butyl-1-methyl-3-[4-(1,1,1-trifluoropropan-2-yl)piperazin-1-yl]indazole;3-(4,4-dimethylpiperazin-4-ium-1-yl)-1-methyl-5-propan-2-ylindazole;1,3-dimethyl-5-propan-2-ylpyrazolo[4,3-d]pyrimidine;1,3-dimethyl-5-(4-propan-2-yl-2-pyridinyl)pyrazolo[4,3-d]pyrimidine;1-methyl-5-[(2S)-1-methyl-4-propan-2-ylpiperazin-2-yl]indazole;1-methyl-5-[(2R)-1-methyl-4-propan-2-ylpiperazin-2-yl]indazole;1-methyl-5-(2-methyl-5-propan-2-yl-3-pyridinyl)pyrazolo[4,5-b]pyridine;2-propan-2-yl-5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazole;6-(4-propan-2-ylpyrimidin-2-yl)quinolin-2-amine
CID 159439054
2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-3-methylbenzo[e]benzimidazole;2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-3-methylimidazo[4,5-h]quinoline;4-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-5-methyl-7-thia-3,5,12-triazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),3,9,11-pentaene;2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-3H-pyrrolo[3,2-h]quinoline;2-[2-(4,7-dimethylpyrazolo[1,5-a]pyrazin-2-yl)ethyl]-[1,2,4]triazolo[5,1-a]isoquinoline;3-methyl-2-[2-[7-methyl-4-(trifluoromethyl)pyrazolo[1,5-a]pyridin-2-yl]ethyl]benzo[e]benzimidazole
CID 159820862
5-tert-butyl-1-methyl-3-[4-(1,1,1-trifluoropropan-2-yl)piperazin-1-yl]indazole;3-(4,4-dimethylpiperazin-4-ium-1-yl)-1-methyl-5-propan-2-ylindazole;1,3-dimethyl-5-propan-2-ylpyrazolo[4,3-d]pyrimidine;1,3-dimethyl-5-(4-propan-2-yl-2-pyridinyl)pyrazolo[4,3-d]pyrimidine;1-methyl-3-(4-methylpiperazin-1-yl)-5-propan-2-ylpyrazolo[4,3-b]pyridine;1-methyl-5-[(2S)-1-methyl-4-propan-2-ylpiperazin-2-yl]indazole;1-methyl-5-[(2R)-1-methyl-4-propan-2-ylpiperazin-2-yl]indazole;1-methyl-5-(2-methyl-5-propan-2-yl-3-pyridinyl)pyrazolo[4,5-b]pyridine;1-methyl-5-propan-2-yl-3-pyridin-3-ylpyrazolo[4,3-b]pyridine;1-methyl-5-propan-2-yl-3-pyrimidin-5-ylindazole;2-propan-2-yl-5-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazole;6-(4-propan-2-ylpyrimidin-2-yl)quinolin-2-amine
CID 160060630

Frequently Asked Questions

What is the IUPAC name of 6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole?
The IUPAC name of 6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole (CID 160719060) is 6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole.
What is the SMILES notation for 6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole?
The canonical SMILES for 6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole is C=C/C=C\c1cncc(-c2ccc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)cc2)c1.C=C/C=C\c1cnnc(-n2c3ccccc3c3c4ccn(-c5ccccc5)c4ccc32)c1.c1ccc(-c2cc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)cnn2)cc1.c1ccc(-c2cnc(-n3c4ccccc4c4c5ccn(-c6ccccc6)c5ccc43)cn2)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5cc6ccccc6s5)c4ccc32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5cncc6ccccc56)c4ccc32)cc1.
What is the InChIKey of 6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole?
The InChIKey is RSVZFZQUIPAAHS-LFOPCZRCSA-N. The full InChI is InChI=1S/C35H25N3.2C30H20N4.C29H19N3.C28H20N4.C28H18N2S/c1-2-3-9-25-22-27(24-36-23-25)26-14-16-29(17-15-26)38-33-13-8-7-12-30(33)35-31-20-21-37(28-10-5-4-6-11-28)32(31)18-19-34(35)38;1-3-9-21(10-4-1)26-19-23(20-31-32-26)34-28-14-8-7-13-24(28)30-25-17-18-33(22-11-5-2-6-12-22)27(25)15-16-29(30)34;1-3-9-21(10-4-1)25-19-32-29(20-31-25)34-27-14-8-7-13-23(27)30-24-17-18-33(22-11-5-2-6-12-22)26(24)15-16-28(30)34;1-2-9-21(10-3-1)31-17-16-24-25(31)14-15-27-29(24)23-12-6-7-13-26(23)32(27)28-19-30-18-20-8-4-5-11-22(20)28;1-2-3-9-20-18-27(30-29-19-20)32-25-13-8-7-12-22(25)28-23-16-17-31(21-10-5-4-6-11-21)24(23)14-15-26(28)32;1-2-9-20(10-3-1)29-17-16-22-23(29)14-15-25-28(22)21-11-5-6-12-24(21)30(25)27-18-19-8-4-7-13-26(19)31-27/h2-24H,1H2;2*1-20H;1-19H;2-19H,1H2;1-18H/b9-3-;;;;9-3-;.
What are the key properties of 6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole?
6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole has a molecular weight of 2597.16 g/mol, XLogP of 45.29, 19 rotatable bonds, 0 hydrogen bond donors, and 21 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-benzothiophen-2-yl)-3-phenylpyrrolo[2,3-c]carbazole;6-[5-[(1Z)-buta-1,3-dienyl]pyridazin-3-yl]-3-phenylpyrrolo[2,3-c]carbazole;6-[4-[5-[(1Z)-buta-1,3-dienyl]-3-pyridinyl]phenyl]-3-phenylpyrrolo[2,3-c]carbazole;6-isoquinolin-4-yl-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-(5-phenylpyrazin-2-yl)pyrrolo[2,3-c]carbazole;3-phenyl-6-(6-phenylpyridazin-4-yl)pyrrolo[2,3-c]carbazole is sourced from PubChem (CID 160719060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).