5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole

C51H33N5 — CID 158151336

IUPAC5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole
SMILESc1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5cccc(-c6ccc7c8ncccc8n(-c8ccccc8)c7c6)c54)c3)cc(-c3ccccn3)n2)cc1
InChIInChI=1S/C51H33N5/c1-3-14-34(15-4-1)45-31-37(32-46(54-45)44-23-9-10-28-52-44)35-16-11-19-39(30-35)56-47-24-8-7-20-41(47)42-22-12-21-40(51(42)56)36-26-27-43-49(33-36)55(38-17-5-2-6-18-38)48-25-13-29-53-50(43)48/h1-33H
InChIKeyGPHMRMANHBGKDX-UHFFFAOYSA-N
MW715.86 g/mol
LogP12.73
Rot. Bonds6

About 5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole

5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole (PubChem CID 158151336) has the molecular formula C51H33N5 and a molecular weight of 715.86 g/mol. Its IUPAC name is 5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole.

Molecular Properties

Compound Name5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole
PubChem CID158151336
Molecular FormulaC51H33N5
Molecular Weight715.86 g/mol
Exact Mass715.27
IUPAC Name5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole
SMILESc1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5cccc(-c6ccc7c8ncccc8n(-c8ccccc8)c7c6)c54)c3)cc(-c3ccccn3)n2)cc1
InChIInChI=1S/C51H33N5/c1-3-14-34(15-4-1)45-31-37(32-46(54-45)44-23-9-10-28-52-44)35-16-11-19-39(30-35)56-47-24-8-7-20-41(47)42-22-12-21-40(51(42)56)36-26-27-43-49(33-36)55(38-17-5-2-6-18-38)48-25-13-29-53-50(43)48/h1-33H
InChIKeyGPHMRMANHBGKDX-UHFFFAOYSA-N
XLogP12.73
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500715.86
LogP ≤ 512.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-7-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole
CID 118587835
8-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-1-yl]-5-phenylpyrido[3,2-b]indole
CID 129221525
7-(9-phenylcarbazol-1-yl)-5-(3-phenylphenyl)pyrido[3,2-b]indole;7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole;5-phenyl-7-(9-phenylcarbazol-1-yl)pyrido[3,2-b]indole;5-(3-phenylphenyl)-7-[9-(4-phenylphenyl)carbazol-1-yl]pyrido[3,2-b]indole
CID 158647779
7-[9-[3-(4,6-diphenyl-2-pyridinyl)phenyl]carbazol-3-yl]-5-phenylpyrido[3,2-b]indole;7-[9-[3-(3,5-dipyridin-2-ylphenyl)phenyl]carbazol-3-yl]-5-phenylpyrido[3,2-b]indole;7-[9-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]carbazol-3-yl]-5-phenylpyrido[3,2-b]indole
CID 159163877
7-[9-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole
CID 129221411
7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole
CID 129221390
9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]-7-(9-phenylcarbazol-1-yl)pyrido[2,3-b]indole
CID 129221363
5-phenyl-8-[9-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)carbazol-2-yl]pyrido[3,2-b]indole
CID 129221692
7-[9-[3-(3,5-dipyridin-2-ylphenyl)phenyl]carbazol-3-yl]-5-phenylpyrido[3,2-b]indole
CID 129221946
9-phenyl-2-[3-(9-phenylcarbazol-2-yl)-5-[4-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]phenyl]carbazole
CID 118289394
2-(3-carbazol-9-ylphenyl)-9-[3-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]phenyl]carbazole
CID 134252122
5-[3-(3,5-dipyridin-2-ylphenyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole;5-[3-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-8-(9-phenylcarbazol-4-yl)pyrido[3,2-b]indole
CID 158500543

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole?
The IUPAC name of 5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole (CID 158151336) is 5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole.
What is the SMILES notation for 5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole?
The canonical SMILES for 5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole is c1ccc(-c2cc(-c3cccc(-n4c5ccccc5c5cccc(-c6ccc7c8ncccc8n(-c8ccccc8)c7c6)c54)c3)cc(-c3ccccn3)n2)cc1.
What is the InChIKey of 5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole?
The InChIKey is GPHMRMANHBGKDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H33N5/c1-3-14-34(15-4-1)45-31-37(32-46(54-45)44-23-9-10-28-52-44)35-16-11-19-39(30-35)56-47-24-8-7-20-41(47)42-22-12-21-40(51(42)56)36-26-27-43-49(33-36)55(38-17-5-2-6-18-38)48-25-13-29-53-50(43)48/h1-33H.
What are the key properties of 5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole?
5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole has a molecular weight of 715.86 g/mol, XLogP of 12.73, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole is sourced from PubChem (CID 158151336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).