9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole

C35H23N3 — CID 129221348

IUPAC9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole
SMILESc1ccc(-n2c3ccccc3c3cccc(-c4cccc5c6ccncc6n(-c6ccccc6)c45)c32)cc1
InChIInChI=1S/C35H23N3/c1-3-11-24(12-4-1)37-32-20-8-7-15-26(32)28-16-9-18-30(34(28)37)31-19-10-17-29-27-21-22-36-23-33(27)38(35(29)31)25-13-5-2-6-14-25/h1-23H
InChIKeyTVDWBKJVHLUTIW-UHFFFAOYSA-N
MW485.59 g/mol
LogP8.94
Rot. Bonds3

About 9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole

9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole (PubChem CID 129221348) has the molecular formula C35H23N3 and a molecular weight of 485.59 g/mol. Its IUPAC name is 9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole.

Molecular Properties

Compound Name9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole
PubChem CID129221348
Molecular FormulaC35H23N3
Molecular Weight485.59 g/mol
Exact Mass485.19
IUPAC Name9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole
SMILESc1ccc(-n2c3ccccc3c3cccc(-c4cccc5c6ccncc6n(-c6ccccc6)c45)c32)cc1
InChIInChI=1S/C35H23N3/c1-3-11-24(12-4-1)37-32-20-8-7-15-26(32)28-16-9-18-30(34(28)37)31-19-10-17-29-27-21-22-36-23-33(27)38(35(29)31)25-13-5-2-6-14-25/h1-23H
InChIKeyTVDWBKJVHLUTIW-UHFFFAOYSA-N
XLogP8.94
TPSA22.75 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms38
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500485.59
LogP ≤ 58.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

9-phenyl-6-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole
CID 129221469
21-phenyl-18,21-diazapentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15(20),16,18-decaene
CID 144568642
7-(9-naphthalen-2-ylcarbazol-1-yl)-9-phenylpyrido[3,4-b]indole
CID 129221374
20-(4,6-diphenyl-1,3,5-triazin-2-yl)-3-phenyl-3,6,20-triazapentacyclo[11.7.0.02,10.04,9.014,19]icosa-1(13),2(10),4(9),5,7,11,14,16,18-nonaene
CID 139524740
5-phenyl-4-(9-phenylcarbazol-1-yl)pyrido[3,2-b]indole
CID 129221355
11-phenylpyrido[3,4-a]carbazole
CID 118403040
1-[2-isoquinolin-8-yl-6-(9-phenylcarbazol-1-yl)pyrimidin-4-yl]-9-phenylcarbazole
CID 71127145
1-(9-phenylcarbazol-1-yl)-9-(3-phenylphenyl)carbazole
CID 137466576
8-(2-methoxyphenyl)-17-(9-phenylcarbazol-3-yl)-14,17-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene
CID 145354139
10-[3-(3-carbazol-9-ylphenyl)phenyl]-14-phenyl-7,10,14-triazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15,17,19-nonaene
CID 139575264
12-(3-carbazol-9-ylphenyl)-11-phenylindolo[2,3-a]carbazole;11-phenyl-12-(3-pyrido[2,3-b]indol-9-ylphenyl)indolo[2,3-a]carbazole;11-phenyl-12-(3-pyrido[3,4-b]indol-9-ylphenyl)indolo[2,3-a]carbazole;11-phenyl-12-(3-pyrido[4,3-b]indol-5-ylphenyl)indolo[2,3-a]carbazole
CID 162076945
9-phenyl-4-[9-(4-phenylphenyl)carbazol-1-yl]pyrido[3,4-b]indole
CID 118587512

Frequently Asked Questions

What is the IUPAC name of 9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole?
The IUPAC name of 9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole (CID 129221348) is 9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole.
What is the SMILES notation for 9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole?
The canonical SMILES for 9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole is c1ccc(-n2c3ccccc3c3cccc(-c4cccc5c6ccncc6n(-c6ccccc6)c45)c32)cc1.
What is the InChIKey of 9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole?
The InChIKey is TVDWBKJVHLUTIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H23N3/c1-3-11-24(12-4-1)37-32-20-8-7-15-26(32)28-16-9-18-30(34(28)37)31-19-10-17-29-27-21-22-36-23-33(27)38(35(29)31)25-13-5-2-6-14-25/h1-23H.
What are the key properties of 9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole?
9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole has a molecular weight of 485.59 g/mol, XLogP of 8.94, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-phenyl-8-(9-phenylcarbazol-1-yl)pyrido[3,4-b]indole is sourced from PubChem (CID 129221348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).