Basic information
- Standard SMILES
CC(=O)c1ccc2c(c1)ncn2-c1cccc(Br)c1- InChIKey
LFCPKPJNVJEKJT-UHFFFAOYSA-N- Molecular formula
- C15H11BrN2O
- Average molar mass
- 315.16 g/mol
- Monoisotopic mass
- 314.00548
Names & identifiers
- Preferred name
- 1-(1-(3-bromophenyl)-1H-benzo[d]imidazol-5-yl)ethanone
- IUPAC
- 1-[1-(3-bromophenyl)benzimidazol-5-yl]ethanone
Names & synonyms
1-(1-(3-bromophenyl)-1H-benzo[d]imidazol-5-yl)ethanone184098-08-6SCHEMBL2188923LFCPKPJNVJEKJT-UHFFFAOYSA-N5-acetyl-1-(3-bromophenyl)benzimidazoleDB-3107871-[1-(3-Bromo-phenyl)-1H-benzoimidazol-5-yl]-ethanone1-(1-(3-Bromophenyl)-1H-benzo[d]imidazol-5-yl)ethan-1-one
Database identifiers
- PubChem CID
- 54030307
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 349
Related reactions
6 records
Compound notes
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