2-(2-Acetylbenzimidazol-1-yl)-1-(4-chlorophenyl)ethanone
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Basic information
- Standard SMILES
CC(=O)c1nc2ccccc2n1CC(=O)c1ccc(Cl)cc1- InChIKey
AABPSESTZLBZAJ-UHFFFAOYSA-N- Molecular formula
- C17H13ClN2O2
- Average molar mass
- 312.7 g/mol
- Monoisotopic mass
- 312.0665554
Names & identifiers
- Preferred name
- 2-(2-Acetylbenzimidazol-1-yl)-1-(4-chlorophenyl)ethanone
- IUPAC
- 2-(2-acetylbenzimidazol-1-yl)-1-(4-chlorophenyl)ethanone
Names & synonyms
NSC674257CHEMBL4039052-(2-acetylbenzimidazol-1-yl)-1-(4-chlorophenyl)ethanoneBDBM50371865NSC-674257NCI60_026323Ethanone, 2-(2-acetyl-1H-benzimidazol-1-yl)-1-(4-chlorophenyl)-
Database identifiers
- PubChem CID
- 384455
- ChEMBL
CHEMBL403905
Properties
Computed structural propertiesFilling in
- XLogP
- 3.6
- Topological polar surface area
- 52 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 434
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