2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile

C150H86N10S4 — CID 158583627

IUPAC2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile
SMILESN#Cc1cc(-c2cccc(C#N)c2-n2c3ccccc3c3ccccc32)ccc1-c1ccc2sc3ccccc3c2c1.N#Cc1cc(-c2ccccc2-n2c3ccccc3c3ccccc32)ccc1-c1ccc2sc3ccccc3c2c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1c(C#N)cccc1-c1ccc(-c2ccc3sc4ccccc4c3c2)cc1.N#Cc1cccc(-c2ccc(-c3ccc4sc5ccccc5c4c3)cc2)c1-n1c2ccccc2c2ccccc21
InChIInChI=1S/2C38H21N3S.2C37H22N2S/c39-22-26-8-7-12-29(38(26)41-34-13-4-1-9-30(34)31-10-2-5-14-35(31)41)24-16-18-28(27(20-24)23-40)25-17-19-37-33(21-25)32-11-3-6-15-36(32)42-37;39-22-24-12-18-35-32(20-24)30-7-1-3-10-34(30)41(35)38-28(23-40)6-5-9-29(38)26-15-13-25(14-16-26)27-17-19-37-33(21-27)31-8-2-4-11-36(31)42-37;38-23-26-21-24(17-19-27(26)25-18-20-37-32(22-25)31-12-4-8-16-36(31)40-37)28-9-1-5-13-33(28)39-34-14-6-2-10-29(34)30-11-3-7-15-35(30)39;38-23-27-8-7-12-28(37(27)39-33-13-4-1-9-29(33)30-10-2-5-14-34(30)39)25-18-16-24(17-19-25)26-20-21-36-32(22-26)31-11-3-6-15-35(31)40-36/h2*1-21H;2*1-22H
InChIKeyHTOARIIQCPBHEQ-UHFFFAOYSA-N
MW2156.68 g/mol
LogP41.17
Rot. Bonds12

About 2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile

2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile (PubChem CID 158583627) has the molecular formula C150H86N10S4 and a molecular weight of 2156.68 g/mol. Its IUPAC name is 2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile.

Molecular Properties

Compound Name2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile
PubChem CID158583627
Molecular FormulaC150H86N10S4
Molecular Weight2156.68 g/mol
Exact Mass2154.59
IUPAC Name2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile
SMILESN#Cc1cc(-c2cccc(C#N)c2-n2c3ccccc3c3ccccc32)ccc1-c1ccc2sc3ccccc3c2c1.N#Cc1cc(-c2ccccc2-n2c3ccccc3c3ccccc32)ccc1-c1ccc2sc3ccccc3c2c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1c(C#N)cccc1-c1ccc(-c2ccc3sc4ccccc4c3c2)cc1.N#Cc1cccc(-c2ccc(-c3ccc4sc5ccccc5c4c3)cc2)c1-n1c2ccccc2c2ccccc21
InChIInChI=1S/2C38H21N3S.2C37H22N2S/c39-22-26-8-7-12-29(38(26)41-34-13-4-1-9-30(34)31-10-2-5-14-35(31)41)24-16-18-28(27(20-24)23-40)25-17-19-37-33(21-25)32-11-3-6-15-36(32)42-37;39-22-24-12-18-35-32(20-24)30-7-1-3-10-34(30)41(35)38-28(23-40)6-5-9-29(38)26-15-13-25(14-16-26)27-17-19-37-33(21-27)31-8-2-4-11-36(31)42-37;38-23-26-21-24(17-19-27(26)25-18-20-37-32(22-25)31-12-4-8-16-36(31)40-37)28-9-1-5-13-33(28)39-34-14-6-2-10-29(34)30-11-3-7-15-35(30)39;38-23-27-8-7-12-28(37(27)39-33-13-4-1-9-29(33)30-10-2-5-14-34(30)39)25-18-16-24(17-19-25)26-20-21-36-32(22-26)31-11-3-6-15-35(31)40-36/h2*1-21H;2*1-22H
InChIKeyHTOARIIQCPBHEQ-UHFFFAOYSA-N
XLogP41.17
TPSA162.46 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds12
Heavy Atoms164
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002156.68
LogP ≤ 541.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Analyze 2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

9-[2-cyano-6-(8-cyanodibenzothiophen-2-yl)phenyl]carbazole-3-carbonitrile
CID 122575971
2-carbazol-9-yl-3-(4-cyano-3-dibenzothiophen-2-ylphenyl)benzonitrile;3-(2-carbazol-9-ylphenyl)-5-dibenzothiophen-2-ylbenzonitrile;4-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile
CID 163585093
8-(2-carbazol-9-yl-3-cyanophenyl)dibenzothiophene-2-carbonitrile;8-(2-carbazol-9-yl-4-cyanophenyl)dibenzothiophene-2-carbonitrile;8-(2-carbazol-9-yl-5-cyanophenyl)dibenzothiophene-2-carbonitrile;8-(2-carbazol-9-yl-6-cyanophenyl)dibenzothiophene-2-carbonitrile;7-(2-carbazol-9-ylphenyl)dibenzothiophene-3-carbonitrile
CID 163831971
9-[3-[4-(2-carbazol-9-yl-3-cyanophenyl)-2-cyanophenyl]phenyl]carbazole-3-carbonitrile
CID 155081749
8-[2-(2-carbazol-9-yl-3-cyanophenyl)-6-cyanophenyl]dibenzothiophene-2-carbonitrile;2-carbazol-9-yl-3-(2-dibenzothiophen-2-yl-3-fluorophenyl)benzonitrile;3-carbazol-9-yl-4-(2-dibenzothiophen-2-ylphenyl)benzene-1,2-dicarbonitrile;8-[2-(2-carbazol-9-ylphenyl)-6-cyanophenyl]dibenzothiophene-2-carbonitrile;9-[2-cyano-6-(2-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile
CID 159222911
2-carbazol-9-yl-3-[18-(3-cyanophenyl)-10,14-dithiapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15(20),16,18-nonaen-6-yl]benzonitrile
CID 126582418
8-(2-carbazol-9-ylphenyl)dibenzothiophene-3-carbonitrile
CID 126577581
2-carbazol-9-yl-3-[16-(2-cyanophenyl)-10,20-dithiapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-6-yl]benzonitrile
CID 126582442
3-carbazol-9-yl-2-(2-cyano-4-dibenzofuran-2-ylphenyl)benzonitrile;3-carbazol-9-yl-4-(4-dibenzofuran-2-ylphenyl)benzene-1,2-dicarbonitrile;8-[4-(2-carbazol-9-ylphenyl)-2-cyanophenyl]dibenzofuran-2-carbonitrile;9-[2-cyano-6-(4-dibenzofuran-2-ylphenyl)phenyl]carbazole-3-carbonitrile
CID 165075968
9-[2-[3-cyano-4-[4-(4-cyanocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile
CID 155080172
9-[4-[2-cyano-4-[2-(4-cyanocarbazol-9-yl)phenyl]phenyl]phenyl]carbazole-3-carbonitrile
CID 155080180
2-carbazol-9-yl-3-[3-carbazol-9-yl-5-(2-cyanophenyl)phenyl]benzonitrile;2-[2-carbazol-9-yl-4-(2-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[3-(2-carbazol-9-ylphenyl)-5-(3-cyanophenyl)phenyl]carbazole-3,6-dicarbonitrile;9-[3-[3-cyano-2-(3-cyanocarbazol-9-yl)phenyl]-5-phenylphenyl]carbazole-3-carbonitrile
CID 163551344

Frequently Asked Questions

What is the IUPAC name of 2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile?
The IUPAC name of 2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile (CID 158583627) is 2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile.
What is the SMILES notation for 2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile?
The canonical SMILES for 2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile is N#Cc1cc(-c2cccc(C#N)c2-n2c3ccccc3c3ccccc32)ccc1-c1ccc2sc3ccccc3c2c1.N#Cc1cc(-c2ccccc2-n2c3ccccc3c3ccccc32)ccc1-c1ccc2sc3ccccc3c2c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1c(C#N)cccc1-c1ccc(-c2ccc3sc4ccccc4c3c2)cc1.N#Cc1cccc(-c2ccc(-c3ccc4sc5ccccc5c4c3)cc2)c1-n1c2ccccc2c2ccccc21.
What is the InChIKey of 2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile?
The InChIKey is HTOARIIQCPBHEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C38H21N3S.2C37H22N2S/c39-22-26-8-7-12-29(38(26)41-34-13-4-1-9-30(34)31-10-2-5-14-35(31)41)24-16-18-28(27(20-24)23-40)25-17-19-37-33(21-25)32-11-3-6-15-36(32)42-37;39-22-24-12-18-35-32(20-24)30-7-1-3-10-34(30)41(35)38-28(23-40)6-5-9-29(38)26-15-13-25(14-16-26)27-17-19-37-33(21-27)31-8-2-4-11-36(31)42-37;38-23-26-21-24(17-19-27(26)25-18-20-37-32(22-25)31-12-4-8-16-36(31)40-37)28-9-1-5-13-33(28)39-34-14-6-2-10-29(34)30-11-3-7-15-35(30)39;38-23-27-8-7-12-28(37(27)39-33-13-4-1-9-29(33)30-10-2-5-14-34(30)39)25-18-16-24(17-19-25)26-20-21-36-32(22-26)31-11-3-6-15-35(31)40-36/h2*1-21H;2*1-22H.
What are the key properties of 2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile?
2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile has a molecular weight of 2156.68 g/mol, XLogP of 41.17, 12 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-carbazol-9-yl-3-(3-cyano-4-dibenzothiophen-2-ylphenyl)benzonitrile;2-carbazol-9-yl-3-(4-dibenzothiophen-2-ylphenyl)benzonitrile;5-(2-carbazol-9-ylphenyl)-2-dibenzothiophen-2-ylbenzonitrile;9-[2-cyano-6-(4-dibenzothiophen-2-ylphenyl)phenyl]carbazole-3-carbonitrile is sourced from PubChem (CID 158583627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).