(S)-3-((S)-1-(3-fluoropyridin-2-yl)piperidin-3-yl)-6-(2-hydroxy-2-methylpropyl)-6-phenyl-1,3-oxazinan-2-one

HCID 44511971
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Basic information

Standard SMILES
CC(C)(O)C[C@]1(c2ccccc2)CCN([C@H]2CCCN(c3ncccc3F)C2)C(=O)O1
InChIKey
WSANNXMGVHMRGV-CYFREDJKSA-N
Molecular formula
C24H30FN3O3
Average molar mass
427.5 g/mol
Monoisotopic mass
427.22711999

Names & identifiers

Preferred name
(S)-3-((S)-1-(3-fluoropyridin-2-yl)piperidin-3-yl)-6-(2-hydroxy-2-methylpropyl)-6-phenyl-1,3-oxazinan-2-one
IUPAC
(6S)-3-[(3S)-1-(3-fluoro-2-pyridinyl)piperidin-3-yl]-6-(2-hydroxy-2-methylpropyl)-6-phenyl-1,3-oxazinan-2-one

Names & synonyms

SCHEMBL1404223WSANNXMGVHMRGV-CYFREDJKSA-N(S)-3-((S)-1-(3-fluoropyridin-2-yl)piperidin-3-yl)-6-(2-hydroxy-2-methylpropyl)-6-phenyl-1,3-oxazinan-2-one

Database identifiers

PubChem CID
44511971

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
65.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
31

Related reactions

1 records
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Compound notes

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