Basic information
- Standard SMILES
Cc1ccc(-c2ccc(C3CCN(CC(F)(F)F)CC3)cc2)c(Br)c1- InChIKey
FFLDMARYXPTZNW-UHFFFAOYSA-N- Molecular formula
- C20H21BrF3N
- Average molar mass
- 412.3 g/mol
- Monoisotopic mass
- 411.08095
Names & identifiers
- Preferred name
- 4-(2'-Bromo-4'-methylbiphenyl-4-yl)-1-(2,2,2-trifluoroethyl)piperidine
- IUPAC
- 4-[4-(2-bromo-4-methylphenyl)phenyl]-1-(2,2,2-trifluoroethyl)piperidine
Names & synonyms
4-(2'-bromo-4'-methylbiphenyl-4-yl)-1-(2,2,2-trifluoroethyl)piperidineSCHEMBL4390096
Database identifiers
- PubChem CID
- 69025923
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 412
Related reactions
1 records
Compound notes
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