Basic information
- Standard SMILES
C[C@@](CCn1cc(F)c(-c2ccc(Cl)cc2F)cc1=O)(C(=O)NOC1CCCCO1)S(C)(=O)=O- InChIKey
FQIVPTZIBLWLGL-LWMIZPGFSA-N- Molecular formula
- C22H25ClF2N2O6S
- Average molar mass
- 519 g/mol
- Monoisotopic mass
- 518.1089917
Names & identifiers
- Preferred name
- (2R)-4-[4-(4-Chloro-2-fluorophenyl)-5-fluoro-2-oxopyridin-1(2H)-yl]-2-methyl-2-(methylsulfonyl)-N-(tetrahydro-2H-pyran-2-yloxy)butanamide
- IUPAC
- (2R)-4-[4-(4-chloro-2-fluorophenyl)-5-fluoro-2-oxo-1-pyridinyl]-2-methyl-2-methylsulfonyl-N-(oxan-2-yloxy)butanamide
Names & synonyms
SCHEMBL12099727FQIVPTZIBLWLGL-LWMIZPGFSA-N(2R)-4-[4-(4-Chloro-2-fluorophenyl)-5-fluoro-2-oxopyridin-1(2H)-yl]-2-methyl-2-(methylsulfonyl)-N-(tetrahydro-2H-pyran-2-yloxy)butanamide
Database identifiers
- PubChem CID
- 86670643
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 954
Related reactions
4 records
Compound notes
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