Basic information
- Standard SMILES
CC(C)C[C@@H](O)C(=O)N1CCN(c2cccc(-c3ccccc3C(F)F)c2)CC1- InChIKey
QNKKLXLUYAADOP-OAQYLSRUSA-N- Molecular formula
- C23H28F2N2O2
- Average molar mass
- 402.5 g/mol
Names & identifiers
- Preferred name
- (R)-1-[4-(2'-Difluoromethyl-biphenyl-3-yl)-piperazin-1-yl]-2-hydroxy-4-methyl-pentan-1-one
- IUPAC
- (2R)-1-[4-[3-[2-(difluoromethyl)phenyl]phenyl]piperazin-1-yl]-2-hydroxy-4-methylpentan-1-one
Names & synonyms
(R)-1-[4-(2'-Difluoromethyl-biphenyl-3-yl)-piperazin-1-yl]-2-hydroxy-4-methyl-pentan-1-oneSCHEMBL3561020(R)-1-[4-(2'-Difluoromethyl-biphenyl-3-yl)-piperazin-1-yl]-2-hydroxy-4-methyl-pentan -1-one
Database identifiers
- PubChem CID
- 11957763
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 43.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 523
Related reactions
1 records
Compound notes
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