Basic information
- Standard SMILES
CC(C)n1cc(-c2ccc(Cl)c(C(F)(F)F)c2)cc(O)c1=O- InChIKey
QWXXXHMMQLQXDB-UHFFFAOYSA-N- Molecular formula
- C15H13ClF3NO2
- Average molar mass
- 331.72 g/mol
Names & identifiers
- Preferred name
- 1-Isopropyl-3-hydroxy-5-[3-(trifluoromethyl)-4-chlorophenyl]-2(1H)-pyridone
- IUPAC
- 5-[4-chloro-3-(trifluoromethyl)phenyl]-3-hydroxy-1-propan-2-ylpyridin-2-one
Names & synonyms
SCHEMBL24667071-Isopropyl-3-hydroxy-5-[3-(trifluoromethyl)-4-chlorophenyl]-2(1H)-pyridone5-[4-Chloro-3-(trifluoromethyl)phenyl]-3-hydroxy-1-(propan-2-yl)pyridin-2(1H)-one
Database identifiers
- PubChem CID
- 53379809
- Nikkaji
- J3.353.977K
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 513
Related reactions
1 records
Compound notes
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