1-(1,1'-Biphenyl)-4-yl-2-(1H-imidazol-1-yl)ethanone
Basic information
- CAS
72825-24-2- Standard SMILES
O=C(Cn1ccnc1)c1ccc(-c2ccccc2)cc1- InChIKey
CTBDNAHBIPBRTI-UHFFFAOYSA-N- Molecular formula
- C17H14N2O
- Average molar mass
- 262.3 g/mol
- Monoisotopic mass
- 262.11061307
Names & identifiers
- Preferred name
- 1-(1,1'-Biphenyl)-4-yl-2-(1H-imidazol-1-yl)ethanone
- IUPAC
- 2-imidazol-1-yl-1-(4-phenylphenyl)ethanone
Names & synonyms
72825-24-2RefChem:10536861-(1,1'-Biphenyl)-4-yl-2-(1H-imidazol-1-yl)ethanoneCHEMBL423457N-((4-Phenylbenzoyl)methyl)imidazoleBRN 0615360ACETOPHENONE, 2-(1-IMIDAZOLYL)-4'-PHENYL-5-23-04-00381 (Beilstein Handbook Reference)SCHEMBL10247417DTXSID90993619CTBDNAHBIPBRTI-UHFFFAOYSA-NBDBM50526825
Show more names
4-biphenylyl imidazol-1-yl-methyl ketone1-([1,1'-Biphenyl]-4-yl)-2-(1H-imidazol-1-yl)ethan-1-one
Database identifiers
- CAS
72825-24-2- PubChem CID
- 51709
- DTXSID
DTXSID90993619- ChEMBL
CHEMBL423457- Nikkaji
- J90.764B
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 317
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Related reactions
2 records
Compound notes
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