Basic information
- Standard SMILES
FC(F)(F)c1ccccc1CCC1CN(Cc2ccccc2)CCN1Cc1ccccc1- InChIKey
YFIRAKPKBVGSMK-UHFFFAOYSA-N- Molecular formula
- C27H29F3N2
- Average molar mass
- 438.5 g/mol
- Monoisotopic mass
- 438.22828342
Names & identifiers
- Preferred name
- 1,4-Dibenzyl-2-[2-[2-(trifluoromethyl)phenyl]ethyl]piperazine
- IUPAC
- 1,4-dibenzyl-2-[2-[2-(trifluoromethyl)phenyl]ethyl]piperazine
Names & synonyms
SCHEMBL5557313
Database identifiers
- PubChem CID
- 21093612
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 6.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 540
Related reactions
1 records
Compound notes
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