(4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone

C22H18N2O3 — CID 134141506

IUPAC(4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone
SMILESCOc1ccc(C(=O)n2c(-c3ccc(OC)cc3)nc3ccccc32)cc1
InChIInChI=1S/C22H18N2O3/c1-26-17-11-7-15(8-12-17)21-23-19-5-3-4-6-20(19)24(21)22(25)16-9-13-18(27-2)14-10-16/h3-14H,1-2H3
InChIKeyPXJXUUDEYSHZAX-UHFFFAOYSA-N
MW358.40 g/mol
LogP4.41
Rot. Bonds4

About (4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone

(4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone (PubChem CID 134141506) has the molecular formula C22H18N2O3 and a molecular weight of 358.40 g/mol. Its IUPAC name is (4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone.

Molecular Properties

Compound Name(4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone
PubChem CID134141506
Molecular FormulaC22H18N2O3
Molecular Weight358.40 g/mol
Exact Mass358.13
IUPAC Name(4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone
SMILESCOc1ccc(C(=O)n2c(-c3ccc(OC)cc3)nc3ccccc32)cc1
InChIInChI=1S/C22H18N2O3/c1-26-17-11-7-15(8-12-17)21-23-19-5-3-4-6-20(19)24(21)22(25)16-9-13-18(27-2)14-10-16/h3-14H,1-2H3
InChIKeyPXJXUUDEYSHZAX-UHFFFAOYSA-N
XLogP4.41
TPSA53.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone 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 (4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone?
The IUPAC name of (4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone (CID 134141506) is (4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone.
What is the SMILES notation for (4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone?
The canonical SMILES for (4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone is COc1ccc(C(=O)n2c(-c3ccc(OC)cc3)nc3ccccc32)cc1.
What is the InChIKey of (4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone?
The InChIKey is PXJXUUDEYSHZAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O3/c1-26-17-11-7-15(8-12-17)21-23-19-5-3-4-6-20(19)24(21)22(25)16-9-13-18(27-2)14-10-16/h3-14H,1-2H3.
What are the key properties of (4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone?
(4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone has a molecular weight of 358.40 g/mol, XLogP of 4.41, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-[2-(4-methoxyphenyl)benzimidazol-1-yl]methanone is sourced from PubChem (CID 134141506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).