Basic information
- Standard SMILES
Cc1cc(-c2ccc(C(C)N3CCC(CC(C)(C)O)(c4ccc(F)cc4)OC3=O)cc2)ccn1- InChIKey
YWGVOHXMCPUUOM-UHFFFAOYSA-N- Molecular formula
- C28H31FN2O3
- Average molar mass
- 462.6 g/mol
Names & identifiers
- Preferred name
- 6-(4-Fluorophenyl)-6-(2-hydroxy-2-methylpropyl)-3-[1-[4-(2-methyl-4-pyridinyl)phenyl]ethyl]-1,3-oxazinan-2-one
- IUPAC
- 6-(4-fluorophenyl)-6-(2-hydroxy-2-methylpropyl)-3-[1-[4-(2-methyl-4-pyridinyl)phenyl]ethyl]-1,3-oxazinan-2-one
Database identifiers
- PubChem CID
- 91078759
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 62.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 687
Related reactions
1 records
Compound notes
Loading…