(1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol

C22H20N2O — CID 629996

IUPAC(1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol
SMILESCc1ccc(C(O)(c2ccccc2)c2nc3ccccc3n2C)cc1
InChIInChI=1S/C22H20N2O/c1-16-12-14-18(15-13-16)22(25,17-8-4-3-5-9-17)21-23-19-10-6-7-11-20(19)24(21)2/h3-15,25H,1-2H3
InChIKeyYNVSRVMOTYBHLD-UHFFFAOYSA-N
MW328.42 g/mol
LogP4.17
Rot. Bonds3

About (1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol

(1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol (PubChem CID 629996) has the molecular formula C22H20N2O and a molecular weight of 328.42 g/mol. Its IUPAC name is (1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol.

Molecular Properties

Compound Name(1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol
PubChem CID629996
Molecular FormulaC22H20N2O
Molecular Weight328.42 g/mol
Exact Mass328.16
IUPAC Name(1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol
SMILESCc1ccc(C(O)(c2ccccc2)c2nc3ccccc3n2C)cc1
InChIInChI=1S/C22H20N2O/c1-16-12-14-18(15-13-16)22(25,17-8-4-3-5-9-17)21-23-19-10-6-7-11-20(19)24(21)2/h3-15,25H,1-2H3
InChIKeyYNVSRVMOTYBHLD-UHFFFAOYSA-N
XLogP4.17
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol?
The IUPAC name of (1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol (CID 629996) is (1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol.
What is the SMILES notation for (1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol?
The canonical SMILES for (1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol is Cc1ccc(C(O)(c2ccccc2)c2nc3ccccc3n2C)cc1.
What is the InChIKey of (1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol?
The InChIKey is YNVSRVMOTYBHLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O/c1-16-12-14-18(15-13-16)22(25,17-8-4-3-5-9-17)21-23-19-10-6-7-11-20(19)24(21)2/h3-15,25H,1-2H3.
What are the key properties of (1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol?
(1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol has a molecular weight of 328.42 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylbenzimidazol-2-yl)-(4-methylphenyl)-phenylmethanol is sourced from PubChem (CID 629996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).