Basic information
- CAS
73149-22-1- Standard SMILES
O=c1[nH]c(=O)n(C2OC(CF)C(O)C2O)cc1N1CCOCC1- InChIKey
SLCFSGJZGPHBGV-UHFFFAOYSA-N- Molecular formula
- C13H18FN3O6
- Average molar mass
- 331.3 g/mol
- Monoisotopic mass
- 331.11796346
Names & identifiers
- Preferred name
- 1-[5-(Fluoromethyl)-3,4-dihydroxyoxolan-2-yl]-5-morpholin-4-ylpyrimidine-2,4-dione
- IUPAC
- 1-[5-(fluoromethyl)-3,4-dihydroxyoxolan-2-yl]-5-morpholin-4-ylpyrimidine-2,4-dione
Names & synonyms
NSC354058NSC-354058
Database identifiers
- CAS
73149-22-1- PubChem CID
- 337133
Properties
Computed structural properties
- XLogP
- -1.9
- Topological polar surface area
- 112 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 524
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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