1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole

C27H20Cl2N2 — CID 16987371

IUPAC1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole
SMILESClc1cccc(Cl)c1Cn1c(Cc2ccc(-c3ccccc3)cc2)nc2ccccc21
InChIInChI=1S/C27H20Cl2N2/c28-23-9-6-10-24(29)22(23)18-31-26-12-5-4-11-25(26)30-27(31)17-19-13-15-21(16-14-19)20-7-2-1-3-8-20/h1-16H,17-18H2
InChIKeyQVWQRBVIFIZOJX-UHFFFAOYSA-N
MW443.38 g/mol
LogP7.65
Rot. Bonds5

About 1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole

1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole (PubChem CID 16987371) has the molecular formula C27H20Cl2N2 and a molecular weight of 443.38 g/mol. Its IUPAC name is 1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole.

Molecular Properties

Compound Name1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole
PubChem CID16987371
Molecular FormulaC27H20Cl2N2
Molecular Weight443.38 g/mol
Exact Mass442.10
IUPAC Name1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole
SMILESClc1cccc(Cl)c1Cn1c(Cc2ccc(-c3ccccc3)cc2)nc2ccccc21
InChIInChI=1S/C27H20Cl2N2/c28-23-9-6-10-24(29)22(23)18-31-26-12-5-4-11-25(26)30-27(31)17-19-13-15-21(16-14-19)20-7-2-1-3-8-20/h1-16H,17-18H2
InChIKeyQVWQRBVIFIZOJX-UHFFFAOYSA-N
XLogP7.65
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.38
LogP ≤ 57.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)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

Related Compounds

2-[(4-chlorophenyl)methyl]-1-[(2,6-dichlorophenyl)methyl]benzimidazole
CID 18878418
1-[(4-bromophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole
CID 16987379
1-[(3-methylphenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole
CID 16987368
2-benzyl-1-[(3-chlorophenyl)methyl]benzimidazole
CID 18879539
2-benzyl-1-[(4-fluorophenyl)methyl]benzimidazole
CID 709541
3-[1-[(2,6-dichlorophenyl)methyl]benzimidazol-2-yl]propan-1-ol
CID 2992677
3-[2-[(4-phenylphenyl)methyl]benzimidazol-1-yl]propane-1,2-diol
CID 45144782
4-[[1-[(2,6-dichlorophenyl)methyl]benzimidazol-2-yl]methyl]morpholine
CID 6494342
3-chloro-2-[(2-ethylbenzimidazol-1-yl)methyl]aniline
CID 63745945
1-[(2,6-dichlorophenyl)methyl]-2-(2-phenylethenyl)benzimidazole
CID 2768870
1-[3-(4-chloro-3-methylphenoxy)propyl]-2-[(4-phenylphenyl)methyl]benzimidazole
CID 16987436
1-[(2,6-dichlorophenyl)methyl]-2-(4-methoxyphenyl)benzimidazole
CID 18879455

Frequently Asked Questions

What is the IUPAC name of 1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole?
The IUPAC name of 1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole (CID 16987371) is 1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole.
What is the SMILES notation for 1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole?
The canonical SMILES for 1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole is Clc1cccc(Cl)c1Cn1c(Cc2ccc(-c3ccccc3)cc2)nc2ccccc21.
What is the InChIKey of 1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole?
The InChIKey is QVWQRBVIFIZOJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H20Cl2N2/c28-23-9-6-10-24(29)22(23)18-31-26-12-5-4-11-25(26)30-27(31)17-19-13-15-21(16-14-19)20-7-2-1-3-8-20/h1-16H,17-18H2.
What are the key properties of 1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole?
1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole has a molecular weight of 443.38 g/mol, XLogP of 7.65, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,6-dichlorophenyl)methyl]-2-[(4-phenylphenyl)methyl]benzimidazole is sourced from PubChem (CID 16987371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).