Basic information
- Standard SMILES
COC(=O)c1cc(-c2ccc(F)cc2)c(=O)n(C(C)C(C)(C)O)c1- InChIKey
OOPKMAVXYZSKGB-UHFFFAOYSA-N- Molecular formula
- C18H20FNO4
- Average molar mass
- 333.4 g/mol
Names & identifiers
- Preferred name
- Methyl 5-(4-fluorophenyl)-1-(3-hydroxy-3-methylbutan-2-yl)-6-oxo-1,6-dihydropyridine-3-carboxylate
- IUPAC
- methyl 5-(4-fluorophenyl)-1-(3-hydroxy-3-methylbutan-2-yl)-6-oxopyridine-3-carboxylate
Names & synonyms
SCHEMBL2260734OOPKMAVXYZSKGB-UHFFFAOYSA-NMethyl 5-(4-fluorophenyl)-1-(3-hydroxy-3-methylbutan-2-yl)-6-oxo-1,6-dihydropyridine-3-carboxylate
Database identifiers
- PubChem CID
- 67338292
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 574
Related reactions
3 records
Compound notes
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