5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile

C43H26N4 — CID 134597896

IUPAC5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile
SMILESN#Cc1ccc2c3ccc4c(c5ccccc5n4-c4ccccc4)c3n(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)c2c1
InChIInChI=1S/C43H26N4/c44-27-28-19-21-34-35-23-24-39-42(36-16-8-10-18-38(36)45(39)29-11-3-1-4-12-29)43(35)47(40(34)25-28)31-20-22-33-32-15-7-9-17-37(32)46(41(33)26-31)30-13-5-2-6-14-30/h1-26H
InChIKeyOGPUXYNLLSMKRA-UHFFFAOYSA-N
MW598.71 g/mol
LogP10.85
Rot. Bonds3

About 5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile

5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile (PubChem CID 134597896) has the molecular formula C43H26N4 and a molecular weight of 598.71 g/mol. Its IUPAC name is 5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile.

Molecular Properties

Compound Name5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile
PubChem CID134597896
Molecular FormulaC43H26N4
Molecular Weight598.71 g/mol
Exact Mass598.22
IUPAC Name5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile
SMILESN#Cc1ccc2c3ccc4c(c5ccccc5n4-c4ccccc4)c3n(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)c2c1
InChIInChI=1S/C43H26N4/c44-27-28-19-21-34-35-23-24-39-42(36-16-8-10-18-38(36)45(39)29-11-3-1-4-12-29)43(35)47(40(34)25-28)31-20-22-33-32-15-7-9-17-37(32)46(41(33)26-31)30-13-5-2-6-14-30/h1-26H
InChIKeyOGPUXYNLLSMKRA-UHFFFAOYSA-N
XLogP10.85
TPSA38.58 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms47
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500598.71
LogP ≤ 510.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5,12-diphenyl-9-(5-phenylindolo[3,2-c]carbazol-12-yl)indolo[2,3-g]carbazole-3-carbonitrile
CID 134598027
9-phenyl-6-(5-phenylindolo[3,2-c]carbazol-12-yl)carbazole-3-carbonitrile
CID 134597965
4-[4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]benzonitrile
CID 118543647
6-(4-cyanophenyl)-15,24-diphenyl-6,15,24-triazaheptacyclo[14.11.0.02,14.05,13.07,12.017,25.018,23]heptacosa-1(16),2(14),3,5(13),7(12),8,10,17(25),18,20,22,26-dodecaene-10-carbonitrile
CID 146180291
5-[7-(2,6-diphenylpyrimidin-4-yl)-9-phenylcarbazol-2-yl]-12-phenylindolo[3,2-c]carbazole;5-[7-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-phenylcarbazol-2-yl]-12-phenylindolo[3,2-c]carbazole;9-phenyl-7-(12-phenylindolo[3,2-c]carbazol-5-yl)carbazole-2-carbonitrile
CID 160551737
4-[4-(5-phenylindolo[3,2-c]carbazol-12-yl)phenyl]sulfanylbenzonitrile
CID 171844554
12-phenyl-5-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-8-carbonitrile
CID 134597839
5-(9-phenylcarbazol-2-yl)-12-(4-phenylphenyl)indolo[3,2-c]carbazole
CID 134168829
4-[4-(11,24-diphenyl-11,15,24-triazaheptacyclo[14.11.0.02,14.04,12.05,10.017,25.018,23]heptacosa-1(16),2(14),3,5,7,9,12,17(25),18,20,22,26-dodecaen-15-yl)phenyl]sulfonylbenzonitrile
CID 175631748
2-[2-phenyl-4-(12-phenylindolo[3,2-c]carbazol-5-yl)phenyl]benzene-1,4-dicarbonitrile
CID 140903238
9-(2,6-diphenylpyrimidin-4-yl)-12-phenyl-5-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole;10-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-phenyl-5-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole;12-phenyl-5-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-9-carbonitrile
CID 161446776
4-carbazol-9-yl-3,5-bis(12-phenylindolo[3,2-c]carbazol-5-yl)benzonitrile
CID 163573400

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile?
The IUPAC name of 5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile (CID 134597896) is 5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile.
What is the SMILES notation for 5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile?
The canonical SMILES for 5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile is N#Cc1ccc2c3ccc4c(c5ccccc5n4-c4ccccc4)c3n(-c3ccc4c5ccccc5n(-c5ccccc5)c4c3)c2c1.
What is the InChIKey of 5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile?
The InChIKey is OGPUXYNLLSMKRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H26N4/c44-27-28-19-21-34-35-23-24-39-42(36-16-8-10-18-38(36)45(39)29-11-3-1-4-12-29)43(35)47(40(34)25-28)31-20-22-33-32-15-7-9-17-37(32)46(41(33)26-31)30-13-5-2-6-14-30/h1-26H.
What are the key properties of 5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile?
5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile has a molecular weight of 598.71 g/mol, XLogP of 10.85, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-12-(9-phenylcarbazol-2-yl)indolo[3,2-c]carbazole-10-carbonitrile is sourced from PubChem (CID 134597896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).