Basic information
- Standard SMILES
CN(CC(CC=O)c1ccc(F)cc1)C(=O)c1cc(Br)cc(C(F)(F)F)c1- InChIKey
UNMVUHSNHPGTPH-UHFFFAOYSA-N- Molecular formula
- C19H16BrF4NO2
- Average molar mass
- 446.2 g/mol
Names & identifiers
- Preferred name
- 3-bromo-N-[2-(4-fluorophenyl)-4-oxobutyl]-N-methyl-5-(trifluoromethyl)benzamide
- IUPAC
- 3-bromo-N-[2-(4-fluorophenyl)-4-oxobutyl]-N-methyl-5-(trifluoromethyl)benzamide
Names & synonyms
SCHEMBL4259182UNMVUHSNHPGTPH-UHFFFAOYSA-N3-bromo-N-[2-(4-fluorophenyl)-4-oxobutyl]-N-methyl-5-(trifluoromethyl)benzamide
Database identifiers
- PubChem CID
- 59612873
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 508
Related reactions
2 records
Compound notes
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