3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile

C165H111N7 — CID 164993566

IUPAC3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile
SMILESCc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc2c(c1)c1ccccc1n2-c1cccc(-c2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)c1ccccc1n2-c1cccc(-c2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)c1.c1ccc(-c2cc(-c3ccccc3)c(-c3cccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)c3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C56H40N2.C55H35N3.C54H36N2/c1-37-25-28-53-49(31-37)50-32-38(2)26-29-54(50)58(53)45-27-30-55-51(36-45)46-23-12-13-24-52(46)57(55)44-22-14-21-42(33-44)56-47(40-17-8-4-9-18-40)34-43(39-15-6-3-7-16-39)35-48(56)41-19-10-5-11-20-41;56-36-37-27-29-53-49(31-37)45-23-10-12-25-51(45)58(53)44-28-30-54-50(35-44)46-24-11-13-26-52(46)57(54)43-22-14-21-41(32-43)55-47(39-17-6-2-7-18-39)33-42(38-15-4-1-5-16-38)34-48(55)40-19-8-3-9-20-40;1-4-17-37(18-5-1)41-34-47(38-19-6-2-7-20-38)54(48(35-41)39-21-8-3-9-22-39)40-23-16-24-42(33-40)55-52-30-15-12-27-46(52)49-36-43(31-32-53(49)55)56-50-28-13-10-25-44(50)45-26-11-14-29-51(45)56/h3-36H,1-2H3;1-35H;1-36H
InChIKeyHFHXVRIOYGKLBF-UHFFFAOYSA-N
MW2191.75 g/mol
LogP44.13
Rot. Bonds18

About 3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile

3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile (PubChem CID 164993566) has the molecular formula C165H111N7 and a molecular weight of 2191.75 g/mol. Its IUPAC name is 3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile.

Molecular Properties

Compound Name3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile
PubChem CID164993566
Molecular FormulaC165H111N7
Molecular Weight2191.75 g/mol
Exact Mass2189.89
IUPAC Name3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile
SMILESCc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc2c(c1)c1ccccc1n2-c1cccc(-c2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)c1ccccc1n2-c1cccc(-c2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)c1.c1ccc(-c2cc(-c3ccccc3)c(-c3cccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)c3)c(-c3ccccc3)c2)cc1
InChIInChI=1S/C56H40N2.C55H35N3.C54H36N2/c1-37-25-28-53-49(31-37)50-32-38(2)26-29-54(50)58(53)45-27-30-55-51(36-45)46-23-12-13-24-52(46)57(55)44-22-14-21-42(33-44)56-47(40-17-8-4-9-18-40)34-43(39-15-6-3-7-16-39)35-48(56)41-19-10-5-11-20-41;56-36-37-27-29-53-49(31-37)45-23-10-12-25-51(45)58(53)44-28-30-54-50(35-44)46-24-11-13-26-52(46)57(54)43-22-14-21-41(32-43)55-47(39-17-6-2-7-18-39)33-42(38-15-4-1-5-16-38)34-48(55)40-19-8-3-9-20-40;1-4-17-37(18-5-1)41-34-47(38-19-6-2-7-20-38)54(48(35-41)39-21-8-3-9-22-39)40-23-16-24-42(33-40)55-52-30-15-12-27-46(52)49-36-43(31-32-53(49)55)56-50-28-13-10-25-44(50)45-26-11-14-29-51(45)56/h3-36H,1-2H3;1-35H;1-36H
InChIKeyHFHXVRIOYGKLBF-UHFFFAOYSA-N
XLogP44.13
TPSA53.37 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds18
Heavy Atoms172
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002191.75
LogP ≤ 544.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]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

2-methyl-6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;2-methyl-7-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole;6-(9-phenylcarbazol-3-yl)-9-[3-(4-phenylphenyl)phenyl]carbazole-3-carbonitrile
CID 160584678
5-[4-(3-methylcarbazol-9-yl)phenyl]-2,3-diphenylbenzonitrile
CID 156678725
9-[3-[3,5-di(carbazol-9-yl)phenyl]phenyl]carbazole-3-carbonitrile
CID 118650216
6-carbazol-9-yl-9-phenylcarbazole-3-carbonitrile
CID 134597724
4-[3-[4-[3,6-di(carbazol-9-yl)carbazol-9-yl]phenyl]-2-phenylphenyl]benzonitrile
CID 138675154
9-[3-[4-(3-carbazol-9-ylcarbazol-9-yl)-2-cyanophenyl]phenyl]carbazole-3-carbonitrile
CID 154958752
4-[4-[3-[9-(3-phenylphenyl)carbazol-3-yl]carbazol-9-yl]phenyl]benzonitrile
CID 126747004
3-carbazol-9-yl-9-[3-[2,4,6-tris(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]carbazole;3,6-ditert-butyl-9-[9-[3-[2,4,6-tris(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]carbazol-3-yl]carbazole;9-[9-[3-[2,4,6-tris(2,3,4,5,6-pentadeuteriophenyl)phenyl]phenyl]carbazol-3-yl]carbazole-3-carbonitrile
CID 164950108
2-[4-(3-carbazol-9-ylcarbazol-9-yl)-2,6-diphenylphenyl]benzene-1,4-dicarbonitrile
CID 140903234
3-[4-(3-carbazol-9-ylphenyl)phenyl]-4-(10-phenylanthracen-9-yl)benzonitrile
CID 167336584
3-[4-(6,9-diphenylcarbazol-3-yl)phenyl]-6,9-diphenylcarbazole;9-phenyl-6-[4-(9-phenylcarbazol-3-yl)phenyl]carbazole-3-carbonitrile
CID 159170044
9-[8-[8-(3-methylcarbazol-9-yl)dibenzothiophen-2-yl]dibenzothiophen-2-yl]carbazole-3-carbonitrile
CID 118396704

Frequently Asked Questions

What is the IUPAC name of 3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile?
The IUPAC name of 3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile (CID 164993566) is 3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile.
What is the SMILES notation for 3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile?
The canonical SMILES for 3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile is Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc2c(c1)c1ccccc1n2-c1cccc(-c2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)c1.N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc2c(c1)c1ccccc1n2-c1cccc(-c2c(-c3ccccc3)cc(-c3ccccc3)cc2-c2ccccc2)c1.c1ccc(-c2cc(-c3ccccc3)c(-c3cccc(-n4c5ccccc5c5cc(-n6c7ccccc7c7ccccc76)ccc54)c3)c(-c3ccccc3)c2)cc1.
What is the InChIKey of 3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile?
The InChIKey is HFHXVRIOYGKLBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H40N2.C55H35N3.C54H36N2/c1-37-25-28-53-49(31-37)50-32-38(2)26-29-54(50)58(53)45-27-30-55-51(36-45)46-23-12-13-24-52(46)57(55)44-22-14-21-42(33-44)56-47(40-17-8-4-9-18-40)34-43(39-15-6-3-7-16-39)35-48(56)41-19-10-5-11-20-41;56-36-37-27-29-53-49(31-37)45-23-10-12-25-51(45)58(53)44-28-30-54-50(35-44)46-24-11-13-26-52(46)57(54)43-22-14-21-41(32-43)55-47(39-17-6-2-7-18-39)33-42(38-15-4-1-5-16-38)34-48(55)40-19-8-3-9-20-40;1-4-17-37(18-5-1)41-34-47(38-19-6-2-7-20-38)54(48(35-41)39-21-8-3-9-22-39)40-23-16-24-42(33-40)55-52-30-15-12-27-46(52)49-36-43(31-32-53(49)55)56-50-28-13-10-25-44(50)45-26-11-14-29-51(45)56/h3-36H,1-2H3;1-35H;1-36H.
What are the key properties of 3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile?
3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile has a molecular weight of 2191.75 g/mol, XLogP of 44.13, 18 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-carbazol-9-yl-9-[3-(2,4,6-triphenylphenyl)phenyl]carbazole;3,6-dimethyl-9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole;9-[9-[3-(2,4,6-triphenylphenyl)phenyl]carbazol-3-yl]carbazole-3-carbonitrile is sourced from PubChem (CID 164993566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).