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

C20H12Cl2N2O — CID 21177132

IUPAC(4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone
SMILESO=C(c1ccc(Cl)cc1)n1c(-c2ccc(Cl)cc2)nc2ccccc21
InChIInChI=1S/C20H12Cl2N2O/c21-15-9-5-13(6-10-15)19-23-17-3-1-2-4-18(17)24(19)20(25)14-7-11-16(22)12-8-14/h1-12H
InChIKeyWTNKJLRTGDZBIG-UHFFFAOYSA-N
MW367.24 g/mol
LogP5.70
Rot. Bonds2

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

(4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone (PubChem CID 21177132) has the molecular formula C20H12Cl2N2O and a molecular weight of 367.24 g/mol. Its IUPAC name is (4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone.

Molecular Properties

Compound Name(4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone
PubChem CID21177132
Molecular FormulaC20H12Cl2N2O
Molecular Weight367.24 g/mol
Exact Mass366.03
IUPAC Name(4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone
SMILESO=C(c1ccc(Cl)cc1)n1c(-c2ccc(Cl)cc2)nc2ccccc21
InChIInChI=1S/C20H12Cl2N2O/c21-15-9-5-13(6-10-15)19-23-17-3-1-2-4-18(17)24(19)20(25)14-7-11-16(22)12-8-14/h1-12H
InChIKeyWTNKJLRTGDZBIG-UHFFFAOYSA-N
XLogP5.70
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500367.24
LogP ≤ 55.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[1-(4-chlorobenzoyl)benzimidazol-2-yl]benzenesulfonic acid
CID 50907932
(2-aminobenzimidazol-1-yl)-(4-chlorophenyl)methanone
CID 1088433
(6-chloro-2-pyridin-4-ylbenzimidazol-1-yl)-phenylmethanone
CID 155599085
2-[2-[2-(4-chlorophenyl)benzimidazol-1-yl]-2-oxoethyl]isoindole-1,3-dione
CID 135122097
[1-(4-chlorobenzoyl)benzimidazol-2-yl]methyl 4-chlorobenzoate
CID 21204758
2-[4-(3,4-dichlorobenzoyl)phenyl]benzimidazole-1-carboxamide
CID 68697794
(5-chloro-2-naphthalen-2-ylbenzimidazol-1-yl)-(3,4-difluorophenyl)methanone
CID 155598951
2-(4-chlorophenyl)-1-methylbenzimidazole
CID 974595
[2-[6-(1-benzoylbenzimidazol-2-yl)-2-pyridinyl]benzimidazol-1-yl]-phenylmethanone;vanadium;trichloride
CID 173243678
(2-ethylbenzimidazol-1-yl)-(4-methylphenyl)methanone
CID 177379362
(2-tert-butylbenzimidazol-1-yl)-(4-phenylphenyl)methanone
CID 175870012
1-(4-chlorobutyl)-2-(4-chlorophenyl)benzimidazole
CID 68599548

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone?
The IUPAC name of (4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone (CID 21177132) is (4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone.
What is the SMILES notation for (4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone?
The canonical SMILES for (4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone is O=C(c1ccc(Cl)cc1)n1c(-c2ccc(Cl)cc2)nc2ccccc21.
What is the InChIKey of (4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone?
The InChIKey is WTNKJLRTGDZBIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12Cl2N2O/c21-15-9-5-13(6-10-15)19-23-17-3-1-2-4-18(17)24(19)20(25)14-7-11-16(22)12-8-14/h1-12H.
What are the key properties of (4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone?
(4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone has a molecular weight of 367.24 g/mol, XLogP of 5.70, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-[2-(4-chlorophenyl)benzimidazol-1-yl]methanone is sourced from PubChem (CID 21177132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).