Basic information
- Standard SMILES
O=C(Cc1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCO[C@](CCO)(c2ccc(Cl)c(Cl)c2)C1- InChIKey
YRYFRWQTDWSZED-FQEVSTJZSA-N- Molecular formula
- C22H19Cl2F6NO3
- Average molar mass
- 530.3 g/mol
Names & identifiers
- Preferred name
- (2R)-2-[4-{[3,5-bis(trifluoromethyl)phenyl]acetyl}-2-(3,4-dichlorophenyl)morpholin-2-yl]ethanol
- IUPAC
- 2-[3,5-bis(trifluoromethyl)phenyl]-1-[(2R)-2-(3,4-dichlorophenyl)-2-(2-hydroxyethyl)morpholin-4-yl]ethanone
Names & synonyms
(2R)-2-[4-{[3,5-bis(trifluoromethyl)phenyl]acetyl}-2-(3,4-dichlorophenyl)morpholin-2-yl]ethanolSCHEMBL3985942
Database identifiers
- PubChem CID
- 86612947
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 5
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 687
Related reactions
2 records
Compound notes
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