(R)-6-allyl-6-(4-fluorophenyl)-3-((S)-1-(4-(2-oxo-1,2-dihydropyridin-3-yl)phenyl)ethyl)-1,3-oxazinan-2-one
Basic information
- Standard SMILES
C=CC[C@]1(c2ccc(F)cc2)CCN([C@@H](C)c2ccc(-c3ccc[nH]c3=O)cc2)C(=O)O1- InChIKey
KCCZRPVDNWVXDA-HFJWLAOPSA-N- Molecular formula
- C26H25FN2O3
- Average molar mass
- 432.5 g/mol
Names & identifiers
- Preferred name
- (R)-6-allyl-6-(4-fluorophenyl)-3-((S)-1-(4-(2-oxo-1,2-dihydropyridin-3-yl)phenyl)ethyl)-1,3-oxazinan-2-one
- IUPAC
- (6R)-6-(4-fluorophenyl)-3-[(1S)-1-[4-(2-oxo-1H-pyridin-3-yl)phenyl]ethyl]-6-prop-2-enyl-1,3-oxazinan-2-one
Names & synonyms
SCHEMBL117631KCCZRPVDNWVXDA-HFJWLAOPSA-N(R)-6-allyl-6-(4-fluorophenyl)-3-((S)-1-(4-(2-oxo-1,2-dihydropyridin-3-yl)phenyl)ethyl)-1,3-oxazinan-2-one
Database identifiers
- PubChem CID
- 59635626
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 778
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Related reactions
13 records
Compound notes
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