Basic information
- Standard SMILES
C[C@@H]1CN(c2ccc(S(=O)(=O)C(F)(F)F)cc2)CCN1- InChIKey
RHNQCZSCIBHAQV-SECBINFHSA-N- Molecular formula
- C12H15F3N2O2S
- Average molar mass
- 308.32 g/mol
Names & identifiers
- Preferred name
- (3R)-3-methyl-1-{4-[(trifluoromethyl)sulfonyl]phenyl}piperazine
- IUPAC
- (3R)-3-methyl-1-[4-(trifluoromethylsulfonyl)phenyl]piperazine
Names & synonyms
(3R)-3-methyl-1-{4-[(trifluoromethyl)sulfonyl]phenyl}piperazineSCHEMBL2247985
Database identifiers
- PubChem CID
- 11580385
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 425
Related reactions
2 records
Compound notes
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