Basic information
- Standard SMILES
COc1ccc(CN2CCC(C(O)(c3ccc(OC(F)(F)F)cc3)c3ccc(OC(F)(F)F)cc3)CC2)cc1Cl- InChIKey
IPEWCZGEQMNMPL-UHFFFAOYSA-N- Molecular formula
- C28H26ClF6NO4
- Average molar mass
- 590 g/mol
Names & identifiers
- Preferred name
- N-(3-chloro-4-methoxyphenylmethyl)-4-[bis(4-trifluoromethoxyphenyl)hydroxymethyl]piperidine
- IUPAC
- [1-[(3-chloro-4-methoxyphenyl)methyl]piperidin-4-yl]-bis[4-(trifluoromethoxy)phenyl]methanol
Names & synonyms
N-(3-chloro-4-methoxyphenylmethyl)-4-[bis(4-trifluoromethoxyphenyl)hydroxymethyl]piperidineSCHEMBL8791188
Database identifiers
- PubChem CID
- 19040933
Properties
Computed structural properties
- XLogP
- 7.8
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 8
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 742
Related reactions
3 records
Compound notes
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