5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole

C37H24N4 — CID 118487924

IUPAC5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole
SMILESc1ccc(-n2cnc3c(-n4c5ccccc5c5cc6c(cc54)c4ccccc4n6-c4ccccc4)cccc32)cc1
InChIInChI=1S/C37H24N4/c1-3-12-25(13-4-1)39-24-38-37-33(39)20-11-21-34(37)41-32-19-10-8-17-28(32)30-22-35-29(23-36(30)41)27-16-7-9-18-31(27)40(35)26-14-5-2-6-15-26/h1-24H
InChIKeySNPNWGKXEJIMEB-UHFFFAOYSA-N
MW524.63 g/mol
LogP9.22
Rot. Bonds3

About 5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole

5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole (PubChem CID 118487924) has the molecular formula C37H24N4 and a molecular weight of 524.63 g/mol. Its IUPAC name is 5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole.

Molecular Properties

Compound Name5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole
PubChem CID118487924
Molecular FormulaC37H24N4
Molecular Weight524.63 g/mol
Exact Mass524.20
IUPAC Name5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole
SMILESc1ccc(-n2cnc3c(-n4c5ccccc5c5cc6c(cc54)c4ccccc4n6-c4ccccc4)cccc32)cc1
InChIInChI=1S/C37H24N4/c1-3-12-25(13-4-1)39-24-38-37-33(39)20-11-21-34(37)41-32-19-10-8-17-28(32)30-22-35-29(23-36(30)41)27-16-7-9-18-31(27)40(35)26-14-5-2-6-15-26/h1-24H
InChIKeySNPNWGKXEJIMEB-UHFFFAOYSA-N
XLogP9.22
TPSA27.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms41
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500524.63
LogP ≤ 59.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

9-phenyl-17-(1-phenylbenzimidazol-4-yl)-9,17-diazahexacyclo[11.11.0.02,10.03,8.016,24.018,23]tetracosa-1(13),2(10),3,5,7,11,14,16(24),18,20,22-undecaene
CID 122465284
5-phenyl-11-(1-phenylbenzimidazol-5-yl)indolo[3,2-b]carbazole
CID 118487922
12,12-dimethyl-22-(1-phenylbenzimidazol-4-yl)-22-azahexacyclo[11.11.0.02,11.03,8.015,23.016,21]tetracosa-1(13),2(11),3,5,7,9,14,16,18,20,23-undecaene
CID 122464457
7-phenyl-5-quinoxalin-5-ylindolo[2,3-b]carbazole
CID 154952521
23-phenyl-6,9,23-triazahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1,3,5,7,9,11,13,15,17,19,21,24-dodecaene
CID 140956768
10,10-dimethyl-5-(1-phenylbenzimidazol-4-yl)indeno[1,2-b]indole
CID 121285583
5-phenyl-11-[2-(3-phenylphenyl)phenyl]indolo[3,2-b]carbazole
CID 164847706
5-phenyl-11-[2-(4-phenylphenyl)phenyl]indolo[3,2-b]carbazole
CID 164847594
11,24-diphenyl-11,16,19,24-tetrazaoctacyclo[19.11.0.02,14.04,12.05,10.015,20.023,31.025,30]dotriaconta-1(21),2(14),3,5,7,9,12,15,17,19,22,25,27,29,31-pentadecaene;11-phenyl-24-(2-phenylphenyl)-11,16,19,24-tetrazaoctacyclo[19.11.0.02,14.04,12.05,10.015,20.023,31.025,30]dotriaconta-1(21),2(14),3,5,7,9,12,15,17,19,22,25,27,29,31-pentadecaene;11-phenyl-24-(3-phenylphenyl)-11,16,19,24-tetrazaoctacyclo[19.11.0.02,14.04,12.05,10.015,20.023,31.025,30]dotriaconta-1(21),2(14),3,5,7,9,12,15,17,19,22,25,27,29,31-pentadecaene;11-phenyl-24-(4-phenylphenyl)-11,16,19,24-tetrazaoctacyclo[19.11.0.02,14.04,12.05,10.015,20.023,31.025,30]dotriaconta-1(21),2(14),3,5,7,9,12,15,17,19,22,25,27,29,31-pentadecaene
CID 161092814
1-phenylbenzimidazol-4-olate
CID 22090442
ethane;5-phenyl-11-pyrimidin-2-ylindolo[3,2-b]carbazole
CID 123300627
23-phenyl-6,23-diazahexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2(7),3,5,8,10,12,14,16(24),17,19,21-dodecaene
CID 140956310

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole?
The IUPAC name of 5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole (CID 118487924) is 5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole.
What is the SMILES notation for 5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole?
The canonical SMILES for 5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole is c1ccc(-n2cnc3c(-n4c5ccccc5c5cc6c(cc54)c4ccccc4n6-c4ccccc4)cccc32)cc1.
What is the InChIKey of 5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole?
The InChIKey is SNPNWGKXEJIMEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H24N4/c1-3-12-25(13-4-1)39-24-38-37-33(39)20-11-21-34(37)41-32-19-10-8-17-28(32)30-22-35-29(23-36(30)41)27-16-7-9-18-31(27)40(35)26-14-5-2-6-15-26/h1-24H.
What are the key properties of 5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole?
5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole has a molecular weight of 524.63 g/mol, XLogP of 9.22, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-11-(1-phenylbenzimidazol-4-yl)indolo[3,2-b]carbazole is sourced from PubChem (CID 118487924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).