2-Propen-1-one, 3-(4-bromophenyl)-1-[4-(phenylamino)phenyl]-
Basic information
- CAS
88681-22-5- Standard SMILES
O=C(C=Cc1ccc(Br)cc1)c1ccc(Nc2ccccc2)cc1- InChIKey
BVBNPDQKKHRDGR-UHFFFAOYSA-N- Molecular formula
- C21H16BrNO
- Average molar mass
- 378.3 g/mol
- Monoisotopic mass
- 377.04153
Names & identifiers
- Preferred name
- 2-Propen-1-one, 3-(4-bromophenyl)-1-[4-(phenylamino)phenyl]-
- IUPAC
- 1-(4-anilinophenyl)-3-(4-bromophenyl)prop-2-en-1-one
Names & synonyms
88681-22-52-Propen-1-one, 3-(4-bromophenyl)-1-[4-(phenylamino)phenyl]-1-(4-anilinophenyl)-3-(4-bromophenyl)prop-2-en-1-oneDTXSID60393263
Database identifiers
- CAS
88681-22-5- PubChem CID
- 3520190
- DTXSID
DTXSID60393263
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 414
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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