Basic information
- Standard SMILES
COc1cc(F)c(C(C)C)cc1-c1cnc(C(F)(F)F)cc1CN1C(=O)O[C@H](c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@@H]1C- InChIKey
AMKPTORXHMYWKY-SXBQZSJRSA-N- Molecular formula
- C29H24F10N2O3
- Average molar mass
- 638.5 g/mol
- Monoisotopic mass
- 638.16272425
Names & identifiers
- Preferred name
- (4S,5R)-5-[3,5-bis(trifluoromethyl)phenyl]-3-{[5-(4-fluoro-5-isopropyl-2-methoxyphenyl)-2-(trifluoromethyl)pyridin-4-yl]methyl}-4-methyl-1,3-oxazolidin-2-one
- IUPAC
- (4S,5R)-5-[3,5-bis(trifluoromethyl)phenyl]-3-[[5-(4-fluoro-2-methoxy-5-propan-2-ylphenyl)-2-(trifluoromethyl)-4-pyridinyl]methyl]-4-methyl-1,3-oxazolidin-2-one
Names & synonyms
(4S,5R)-5-[3,5-bis(trifluoromethyl)phenyl]-3-{[5-(4-fluoro-5-isopropyl-2-methoxyphenyl)-2-(trifluoromethyl)pyridin-4-yl]methyl}-4-methyl-1,3-oxazolidin-2-oneSCHEMBL1506685
Database identifiers
- PubChem CID
- 24969644
Properties
Computed structural properties
- XLogP
- 7.8
- Topological polar surface area
- 51.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 6
- Heavy atoms
- 44
- Formal charge
- 0
- Complexity
- 968
Related reactions
1 records
Compound notes
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