Ethanone, 1-(2-phenyl-1H-benzimidazol-5-yl)-
Basic information
- CAS
91437-90-0- Standard SMILES
CC(=O)c1ccc2nc(-c3ccccc3)[nH]c2c1- InChIKey
ZACVEKOHHBZAQJ-UHFFFAOYSA-N- Molecular formula
- C15H12N2O
- Average molar mass
- 236.27 g/mol
- Monoisotopic mass
- 236.09496301
Names & identifiers
- Preferred name
- Ethanone, 1-(2-phenyl-1H-benzimidazol-5-yl)-
- IUPAC
- 1-(2-phenyl-3H-benzimidazol-5-yl)ethanone
Names & synonyms
1-(2-Phenyl-1H-benzimidazol-5-yl)ethanoneETHANONE, 1-(2-PHENYL-1H-BENZIMIDAZOL-5-YL)-91437-90-0DTXSID40238567RefChem:341112DTXCID90161058CHEMBL2035004SCHEMBL199826781-(2-Phenyl-1H-1,3-benzimidazol-6-yl)ethan-1-one
Database identifiers
- CAS
91437-90-0- PubChem CID
- 56240
- DTXSID
DTXSID40238567- ChEMBL
CHEMBL2035004
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 45.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 312
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Compound notes
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