(S)-6-(2-hydroxy-2-methylpropyl)-3-((S)-1-(4-(1-methyl-2-oxo-1,2-dihydropyridin-4-yl)phenyl)propyl)-6-phenyl-1,3-oxazinan-2-one
Basic information
- Standard SMILES
CC[C@@H](c1ccc(-c2ccn(C)c(=O)c2)cc1)N1CC[C@](CC(C)(C)O)(c2ccccc2)OC1=O- InChIKey
PLRIPZFMRUQNKJ-SVEHJYQDSA-N- Molecular formula
- C29H34N2O4
- Average molar mass
- 474.6 g/mol
- Monoisotopic mass
- 474.25185757
Names & identifiers
- Preferred name
- (S)-6-(2-hydroxy-2-methylpropyl)-3-((S)-1-(4-(1-methyl-2-oxo-1,2-dihydropyridin-4-yl)phenyl)propyl)-6-phenyl-1,3-oxazinan-2-one
- IUPAC
- (6S)-6-(2-hydroxy-2-methylpropyl)-3-[(1S)-1-[4-(1-methyl-2-oxo-4-pyridinyl)phenyl]propyl]-6-phenyl-1,3-oxazinan-2-one
Names & synonyms
SCHEMBL118269CHEMBL3664662PLRIPZFMRUQNKJ-SVEHJYQDSA-NBDBM107606US8575157, 55(S)-6-(2-hydroxy-2-methylpropyl)-3-((S)-1-(4-(1-methyl-2-oxo-1,2-dihydropyridin-4-yl)phenyl)propyl)-6-phenyl-1,3-oxazinan-2-one
Database identifiers
- PubChem CID
- 59635745
- ChEMBL
CHEMBL3664662
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 70.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 836
Related reactions
7 records
Compound notes
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