Basic information
- Standard SMILES
Cn1c(CC(=O)[O-])nc(N2CCOCC2)c(F)c1=O.[Na+]- InChIKey
KBRWSIVXNMGSOK-UHFFFAOYSA-M- Molecular formula
- C11H13FN3NaO4
- Average molar mass
- 293.23 g/mol
- Monoisotopic mass
- 293.07877835
Names & identifiers
- Preferred name
- Sodium (5-fluoro-1-methyl-4-morpholin-4-yl-6-oxo-1,6-dihydropyrimidin-2-yl)acetate
- IUPAC
- sodium 2-(5-fluoro-1-methyl-4-morpholin-4-yl-6-oxopyrimidin-2-yl)acetate
Names & synonyms
KBRWSIVXNMGSOK-UHFFFAOYSA-Msodium (5-fluoro-1-methyl-4-morpholin-4-yl-6-oxo-1,6-dihydropyrimidin-2-yl)acetate
Database identifiers
- PubChem CID
- 57388477
Properties
Computed structural properties
- Topological polar surface area
- 85.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 474
Related reactions
9 records
Compound notes
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