6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol

C43H32N4O — CID 140864229

IUPAC6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol
SMILESCc1cc(-c2nc3c(-c4cc(-c5ccccc5)cc(-c5cc(-c6ccccc6)c(C)cn5)c4)cccc3n2-c2ccccc2)c(O)cn1
InChIInChI=1S/C43H32N4O/c1-28-26-45-39(25-37(28)31-15-8-4-9-16-31)34-23-32(30-13-6-3-7-14-30)22-33(24-34)36-19-12-20-40-42(36)46-43(38-21-29(2)44-27-41(38)48)47(40)35-17-10-5-11-18-35/h3-27,48H,1-2H3
InChIKeyGXJVHNOAZZRNOR-UHFFFAOYSA-N
MW620.76 g/mol
LogP10.47
Rot. Bonds6

About 6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol

6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol (PubChem CID 140864229) has the molecular formula C43H32N4O and a molecular weight of 620.76 g/mol. Its IUPAC name is 6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol.

Molecular Properties

Compound Name6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol
PubChem CID140864229
Molecular FormulaC43H32N4O
Molecular Weight620.76 g/mol
Exact Mass620.26
IUPAC Name6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol
SMILESCc1cc(-c2nc3c(-c4cc(-c5ccccc5)cc(-c5cc(-c6ccccc6)c(C)cn5)c4)cccc3n2-c2ccccc2)c(O)cn1
InChIInChI=1S/C43H32N4O/c1-28-26-45-39(25-37(28)31-15-8-4-9-16-31)34-23-32(30-13-6-3-7-14-30)22-33(24-34)36-19-12-20-40-42(36)46-43(38-21-29(2)44-27-41(38)48)47(40)35-17-10-5-11-18-35/h3-27,48H,1-2H3
InChIKeyGXJVHNOAZZRNOR-UHFFFAOYSA-N
XLogP10.47
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500620.76
LogP ≤ 510.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol 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

3-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-2-ol
CID 140865175
5-tert-butyl-3-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-2-ol
CID 140865377
2-[1-phenyl-4-[3-phenyl-5-[5-(1-phenylethyl)-2-pyridinyl]phenyl]benzimidazol-2-yl]phenol
CID 164742379
3-tert-butyl-5-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-1-phenylbenzimidazol-2-yl]pyridin-4-ol
CID 140865504
4,6-ditert-butyl-2-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)phenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol
CID 140864359
2-[1-phenyl-4-[3-phenyl-5-(4-phenyl-5-trimethylsilyl-2-pyridinyl)phenyl]benzimidazol-2-yl]pyridin-3-ol
CID 140865435
2-[4-[3-(5,6-dideuterio-4-phenyl-2-pyridinyl)phenyl]-1-phenylbenzimidazol-2-yl]phenol
CID 171424927
2-[4-[3-(17-oxa-13-azatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11,13,15-octaen-14-yl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]phenol
CID 162783397
2-[4-[3-tert-butyl-5-(4-methyl-2-pyridinyl)phenyl]-1-phenylbenzimidazol-2-yl]phenol
CID 177094142
2-[1-phenyl-4-[3-phenyl-5-[4-(4-phenylphenyl)-2-pyridinyl]phenyl]benzimidazol-2-yl]pyridin-3-ol
CID 140864165
2-[1-(4-benzylphenyl)-4-[3-phenyl-5-(4-phenyl-2-pyridinyl)phenyl]benzimidazol-2-yl]phenol
CID 164742712
5-tert-butyl-3-[1-methyl-4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]benzimidazol-2-yl]pyridin-2-ol
CID 140864201

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol?
The IUPAC name of 6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol (CID 140864229) is 6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol.
What is the SMILES notation for 6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol?
The canonical SMILES for 6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol is Cc1cc(-c2nc3c(-c4cc(-c5ccccc5)cc(-c5cc(-c6ccccc6)c(C)cn5)c4)cccc3n2-c2ccccc2)c(O)cn1.
What is the InChIKey of 6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol?
The InChIKey is GXJVHNOAZZRNOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H32N4O/c1-28-26-45-39(25-37(28)31-15-8-4-9-16-31)34-23-32(30-13-6-3-7-14-30)22-33(24-34)36-19-12-20-40-42(36)46-43(38-21-29(2)44-27-41(38)48)47(40)35-17-10-5-11-18-35/h3-27,48H,1-2H3.
What are the key properties of 6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol?
6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol has a molecular weight of 620.76 g/mol, XLogP of 10.47, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-[4-[3-(5-methyl-4-phenyl-2-pyridinyl)-5-phenylphenyl]-1-phenylbenzimidazol-2-yl]pyridin-3-ol is sourced from PubChem (CID 140864229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).