Basic information
- Standard SMILES
CCCOc1ccc(CN2CCC(C(O)(c3ccc(Cl)cc3)c3ccc(OC(F)(F)F)cc3)CC2)cc1- InChIKey
OREPXUWELXAZKB-UHFFFAOYSA-N- Molecular formula
- C29H31ClF3NO3
- Average molar mass
- 534 g/mol
Names & identifiers
- Preferred name
- N-(4-propoxyphenylmethyl)-4-[(4-trifluoromethoxyphenyl)(4-chlorophenyl)hydroxymethyl]piperidine
- IUPAC
- (4-chlorophenyl)-[1-[(4-propoxyphenyl)methyl]piperidin-4-yl]-[4-(trifluoromethoxy)phenyl]methanol
Names & synonyms
N-(4-propoxyphenylmethyl)-4-[(4-trifluoromethoxyphenyl)(4-chlorophenyl)hydroxymethyl]piperidineSCHEMBL8792085
Database identifiers
- PubChem CID
- 19040906
Properties
Computed structural properties
- XLogP
- 7.5
- Topological polar surface area
- 41.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 666
Related reactions
3 records
Compound notes
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