Basic information
- Standard SMILES
O=C(c1ccc(F)cc1)c1nccc(-c2cncnc2O)c1F- InChIKey
FJFHZQXHCULKGP-UHFFFAOYSA-N- Molecular formula
- C16H9F2N3O2
- Average molar mass
- 313.26 g/mol
- Monoisotopic mass
- 313.06628286
Names & identifiers
- Preferred name
- (3-Fluoro-4-(4-hydroxypyrimidin-5-yl)pyridin-2-yl)(4-fluorophenyl)methanone
- IUPAC
- 5-[3-fluoro-2-(4-fluorobenzoyl)-4-pyridinyl]-1H-pyrimidin-6-one
Names & synonyms
SCHEMBL14830641FJFHZQXHCULKGP-UHFFFAOYSA-N(3-Fluoro-4-(4-hydroxypyrimidin-5-yl)pyridin-2-yl)(4-fluorophenyl)methanone
Database identifiers
- PubChem CID
- 86730419
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 71.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 541
Related reactions
4 records
Compound notes
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