2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole

C20H14Cl2N2 — CID 15552561

IUPAC2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole
SMILESClc1cccc(Cn2c(-c3cccc(Cl)c3)nc3ccccc32)c1
InChIInChI=1S/C20H14Cl2N2/c21-16-7-3-5-14(11-16)13-24-19-10-2-1-9-18(19)23-20(24)15-6-4-8-17(22)12-15/h1-12H,13H2
InChIKeyMCIGJHKUVADPCX-UHFFFAOYSA-N
MW353.25 g/mol
LogP6.06
Rot. Bonds3

About 2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole

2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole (PubChem CID 15552561) has the molecular formula C20H14Cl2N2 and a molecular weight of 353.25 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole.

Molecular Properties

Compound Name2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole
PubChem CID15552561
Molecular FormulaC20H14Cl2N2
Molecular Weight353.25 g/mol
Exact Mass352.05
IUPAC Name2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole
SMILESClc1cccc(Cn2c(-c3cccc(Cl)c3)nc3ccccc32)c1
InChIInChI=1S/C20H14Cl2N2/c21-16-7-3-5-14(11-16)13-24-19-10-2-1-9-18(19)23-20(24)15-6-4-8-17(22)12-15/h1-12H,13H2
InChIKeyMCIGJHKUVADPCX-UHFFFAOYSA-N
XLogP6.06
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.25
LogP ≤ 56.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole 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 2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole?
The IUPAC name of 2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole (CID 15552561) is 2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole.
What is the SMILES notation for 2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole?
The canonical SMILES for 2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole is Clc1cccc(Cn2c(-c3cccc(Cl)c3)nc3ccccc32)c1.
What is the InChIKey of 2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole?
The InChIKey is MCIGJHKUVADPCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14Cl2N2/c21-16-7-3-5-14(11-16)13-24-19-10-2-1-9-18(19)23-20(24)15-6-4-8-17(22)12-15/h1-12H,13H2.
What are the key properties of 2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole?
2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole has a molecular weight of 353.25 g/mol, XLogP of 6.06, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-1-[(3-chlorophenyl)methyl]benzimidazole is sourced from PubChem (CID 15552561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).