Basic information
- Standard SMILES
Cn1c(=N)c(F)cn(C(=O)Nc2cc(F)cc(F)c2)c1=O- InChIKey
AIXGYCNLHYUGSS-UHFFFAOYSA-N- Molecular formula
- C12H9F3N4O2
- Average molar mass
- 298.22 g/mol
- Monoisotopic mass
- 298.06776003
Names & identifiers
- Preferred name
- N-(3,5-difluorophenyl)-5-fluoro-4-imino-3-methyl-2-oxo-3,4-dihydropyrimidine-1(2H)-carboxamide
- IUPAC
- N-(3,5-difluorophenyl)-5-fluoro-4-imino-3-methyl-2-oxopyrimidine-1-carboxamide
Names & synonyms
SCHEMBL15856131AIXGYCNLHYUGSS-UHFFFAOYSA-NN-(3,5-difluorophenyl)-5-fluoro-4-imino-3-methyl-2-oxo-3,4-dihydropyrimidine-1(2H)-carboxamide
Database identifiers
- PubChem CID
- 90266348
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 76.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 501
Related reactions
1 records
Compound notes
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