2-[3-[1-[4-(2,4-difluorophenyl)phenyl]ethyl]-6-(4-fluorophenyl)-2-oxo-1,3-oxazinan-6-yl]ethyl N-methylcarbamate
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Basic information
- Standard SMILES
CNC(=O)OCCC1(c2ccc(F)cc2)CCN(C(C)c2ccc(-c3ccc(F)cc3F)cc2)C(=O)O1- InChIKey
BRAAFKXBNFFQPW-UHFFFAOYSA-N- Molecular formula
- C28H27F3N2O4
- Average molar mass
- 512.5 g/mol
Names & identifiers
- Preferred name
- 2-[3-[1-[4-(2,4-difluorophenyl)phenyl]ethyl]-6-(4-fluorophenyl)-2-oxo-1,3-oxazinan-6-yl]ethyl N-methylcarbamate
- IUPAC
- 2-[3-[1-[4-(2,4-difluorophenyl)phenyl]ethyl]-6-(4-fluorophenyl)-2-oxo-1,3-oxazinan-6-yl]ethyl N-methylcarbamate
Names & synonyms
SCHEMBL3638079
Database identifiers
- PubChem CID
- 68723045
Properties
Computed structural propertiesFilling in
- XLogP
- 5.5
- Topological polar surface area
- 67.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 8
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 773
Related reactions
1 records
Compound notes
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