7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole

C41H27N3 — CID 129221390

IUPAC7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole
SMILESc1ccc(-c2ccc(-n3c4cc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)ccc4c4ncccc43)cc2)cc1
InChIInChI=1S/C41H27N3/c1-3-11-28(12-4-1)29-20-23-32(24-21-29)43-38-19-10-26-42-40(38)36-25-22-30(27-39(36)43)33-16-9-17-35-34-15-7-8-18-37(34)44(41(33)35)31-13-5-2-6-14-31/h1-27H
InChIKeyVSCXTFACBQQQAV-UHFFFAOYSA-N
MW561.69 g/mol
LogP10.61
Rot. Bonds4

About 7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole

7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole (PubChem CID 129221390) has the molecular formula C41H27N3 and a molecular weight of 561.69 g/mol. Its IUPAC name is 7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole.

Molecular Properties

Compound Name7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole
PubChem CID129221390
Molecular FormulaC41H27N3
Molecular Weight561.69 g/mol
Exact Mass561.22
IUPAC Name7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole
SMILESc1ccc(-c2ccc(-n3c4cc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)ccc4c4ncccc43)cc2)cc1
InChIInChI=1S/C41H27N3/c1-3-11-28(12-4-1)29-20-23-32(24-21-29)43-38-19-10-26-42-40(38)36-25-22-30(27-39(36)43)33-16-9-17-35-34-15-7-8-18-37(34)44(41(33)35)31-13-5-2-6-14-31/h1-27H
InChIKeyVSCXTFACBQQQAV-UHFFFAOYSA-N
XLogP10.61
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.69
LogP ≤ 510.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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-(3,5-dipyridin-2-ylphenyl)carbazol-1-yl]-5-phenylpyrido[3,2-b]indole
CID 129221411
5-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,2-b]indole
CID 129221488
5-phenyl-7-[9-[3-(2-phenyl-6-pyridin-2-yl-4-pyridinyl)phenyl]carbazol-1-yl]pyrido[3,2-b]indole
CID 158151336
5-phenyl-9-(9-phenylcarbazol-2-yl)pyrido[3,2-b]indole
CID 118587992
8-(9-phenylcarbazol-2-yl)-5-(3-phenylphenyl)pyrido[3,2-b]indole;8-(9-phenylcarbazol-2-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole;5-(3-phenylphenyl)-8-[9-(4-phenylphenyl)carbazol-2-yl]pyrido[3,2-b]indole
CID 161395661
5-(3-phenylphenyl)-7-[9-(3-phenylphenyl)carbazol-4-yl]pyrido[3,2-b]indole
CID 118586979
8-[9-[3-(2,6-diphenyl-4-pyridinyl)phenyl]carbazol-1-yl]-5-phenylpyrido[3,2-b]indole
CID 129221525
9-[4-(4,6-diphenyl-1,3,5-triazin-2-yl)phenyl]-7-(9-phenylcarbazol-1-yl)pyrido[2,3-b]indole
CID 129221371
5-[4-[4-(4-pyrido[3,2-b]indol-5-ylphenyl)phenyl]phenyl]pyrido[3,2-b]indole
CID 147682919
7-[9-[4-(4,6-diphenylpyrimidin-2-yl)phenyl]carbazol-1-yl]-9-phenylpyrido[2,3-b]indole
CID 118587665
9-[4-(2,6-diphenyl-4-pyridinyl)phenyl]-7-(9-phenylcarbazol-1-yl)pyrido[2,3-b]indole;9-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-7-(9-phenylcarbazol-1-yl)pyrido[2,3-b]indole;9-[4-(2,6-diphenylpyrimidin-4-yl)phenyl]-7-(9-phenylcarbazol-1-yl)pyrido[2,3-b]indole
CID 162011548

Frequently Asked Questions

What is the IUPAC name of 7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole?
The IUPAC name of 7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole (CID 129221390) is 7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole.
What is the SMILES notation for 7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole?
The canonical SMILES for 7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole is c1ccc(-c2ccc(-n3c4cc(-c5cccc6c7ccccc7n(-c7ccccc7)c56)ccc4c4ncccc43)cc2)cc1.
What is the InChIKey of 7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole?
The InChIKey is VSCXTFACBQQQAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H27N3/c1-3-11-28(12-4-1)29-20-23-32(24-21-29)43-38-19-10-26-42-40(38)36-25-22-30(27-39(36)43)33-16-9-17-35-34-15-7-8-18-37(34)44(41(33)35)31-13-5-2-6-14-31/h1-27H.
What are the key properties of 7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole?
7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole has a molecular weight of 561.69 g/mol, XLogP of 10.61, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(9-phenylcarbazol-1-yl)-5-(4-phenylphenyl)pyrido[3,2-b]indole is sourced from PubChem (CID 129221390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).