2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile

C175H105N15 — CID 160887260

IUPAC2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile
SMILESN#Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc(-c3ccccc3)ccc2-n2c3ccccc3c3cc(C#N)ccc32)cc1C#N.N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc(-c3ccccc3)ccc2-n2c3ccccc3c3ccccc32)cc1C#N.N#Cc1cccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-n3c4ccccc4c4ccccc43)c2)c1.N#Cc1ccccc1-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C45H25N5.C44H26N4.2C43H27N3/c46-26-29-14-18-44-38(22-29)35-10-4-6-12-41(35)49(44)40-20-17-33(24-34(40)28-48)37-25-32(31-8-2-1-3-9-31)16-21-43(37)50-42-13-7-5-11-36(42)39-23-30(27-47)15-19-45(39)50;45-27-29-18-21-44-38(24-29)36-14-6-9-17-42(36)47(44)39-22-20-32(25-33(39)28-46)37-26-31(30-10-2-1-3-11-30)19-23-43(37)48-40-15-7-4-12-34(40)35-13-5-8-16-41(35)48;44-28-29-10-9-11-31(26-29)32-22-25-34(43(27-32)46-41-18-7-3-14-37(41)38-15-4-8-19-42(38)46)30-20-23-33(24-21-30)45-39-16-5-1-12-35(39)36-13-2-6-17-40(36)45;44-28-31-11-1-2-12-33(31)30-23-26-34(43(27-30)46-41-19-9-5-15-37(41)38-16-6-10-20-42(38)46)29-21-24-32(25-22-29)45-39-17-7-3-13-35(39)36-14-4-8-18-40(36)45/h1-25H;1-26H;2*1-27H
InChIKeySNUNWHUUWGZVRR-UHFFFAOYSA-N
MW2417.87 g/mol
LogP43.96
Rot. Bonds16

About 2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile

2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile (PubChem CID 160887260) has the molecular formula C175H105N15 and a molecular weight of 2417.87 g/mol. Its IUPAC name is 2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile.

Molecular Properties

Compound Name2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile
PubChem CID160887260
Molecular FormulaC175H105N15
Molecular Weight2417.87 g/mol
Exact Mass2415.87
IUPAC Name2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile
SMILESN#Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc(-c3ccccc3)ccc2-n2c3ccccc3c3cc(C#N)ccc32)cc1C#N.N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc(-c3ccccc3)ccc2-n2c3ccccc3c3ccccc32)cc1C#N.N#Cc1cccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-n3c4ccccc4c4ccccc43)c2)c1.N#Cc1ccccc1-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-n2c3ccccc3c3ccccc32)c1
InChIInChI=1S/C45H25N5.C44H26N4.2C43H27N3/c46-26-29-14-18-44-38(22-29)35-10-4-6-12-41(35)49(44)40-20-17-33(24-34(40)28-48)37-25-32(31-8-2-1-3-9-31)16-21-43(37)50-42-13-7-5-11-36(42)39-23-30(27-47)15-19-45(39)50;45-27-29-18-21-44-38(24-29)36-14-6-9-17-42(36)47(44)39-22-20-32(25-33(39)28-46)37-26-31(30-10-2-1-3-11-30)19-23-43(37)48-40-15-7-4-12-34(40)35-13-5-8-16-41(35)48;44-28-29-10-9-11-31(26-29)32-22-25-34(43(27-32)46-41-18-7-3-14-37(41)38-15-4-8-19-42(38)46)30-20-23-33(24-21-30)45-39-16-5-1-12-35(39)36-13-2-6-17-40(36)45;44-28-31-11-1-2-12-33(31)30-23-26-34(43(27-30)46-41-19-9-5-15-37(41)38-16-6-10-20-42(38)46)29-21-24-32(25-22-29)45-39-17-7-3-13-35(39)36-14-4-8-18-40(36)45/h1-25H;1-26H;2*1-27H
InChIKeySNUNWHUUWGZVRR-UHFFFAOYSA-N
XLogP43.96
TPSA205.97 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds16
Heavy Atoms190
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002417.87
LogP ≤ 543.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze 2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile?
The IUPAC name of 2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile (CID 160887260) is 2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile.
What is the SMILES notation for 2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile?
The canonical SMILES for 2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile is N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc(-c3ccccc3)ccc2-n2c3ccccc3c3cc(C#N)ccc32)cc1C#N.N#Cc1ccc2c(c1)c1ccccc1n2-c1ccc(-c2cc(-c3ccccc3)ccc2-n2c3ccccc3c3ccccc32)cc1C#N.N#Cc1cccc(-c2ccc(-c3ccc(-n4c5ccccc5c5ccccc54)cc3)c(-n3c4ccccc4c4ccccc43)c2)c1.N#Cc1ccccc1-c1ccc(-c2ccc(-n3c4ccccc4c4ccccc43)cc2)c(-n2c3ccccc3c3ccccc32)c1.
What is the InChIKey of 2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile?
The InChIKey is SNUNWHUUWGZVRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C45H25N5.C44H26N4.2C43H27N3/c46-26-29-14-18-44-38(22-29)35-10-4-6-12-41(35)49(44)40-20-17-33(24-34(40)28-48)37-25-32(31-8-2-1-3-9-31)16-21-43(37)50-42-13-7-5-11-36(42)39-23-30(27-47)15-19-45(39)50;45-27-29-18-21-44-38(24-29)36-14-6-9-17-42(36)47(44)39-22-20-32(25-33(39)28-46)37-26-31(30-10-2-1-3-11-30)19-23-43(37)48-40-15-7-4-12-34(40)35-13-5-8-16-41(35)48;44-28-29-10-9-11-31(26-29)32-22-25-34(43(27-32)46-41-18-7-3-14-37(41)38-15-4-8-19-42(38)46)30-20-23-33(24-21-30)45-39-16-5-1-12-35(39)36-13-2-6-17-40(36)45;44-28-31-11-1-2-12-33(31)30-23-26-34(43(27-30)46-41-19-9-5-15-37(41)38-16-6-10-20-42(38)46)29-21-24-32(25-22-29)45-39-17-7-3-13-35(39)36-14-4-8-18-40(36)45/h1-25H;1-26H;2*1-27H.
What are the key properties of 2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile?
2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile has a molecular weight of 2417.87 g/mol, XLogP of 43.96, 16 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;3-[3-carbazol-9-yl-4-(4-carbazol-9-ylphenyl)phenyl]benzonitrile;9-[4-(2-carbazol-9-yl-5-phenylphenyl)-2-cyanophenyl]carbazole-3-carbonitrile;9-[2-cyano-4-[2-(3-cyanocarbazol-9-yl)-5-phenylphenyl]phenyl]carbazole-3-carbonitrile is sourced from PubChem (CID 160887260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).