(+/-)-[4-(2-Fluoromethylmorpholin-4-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]acetic acid ethyl ester
Basic information
- Standard SMILES
CCOC(=O)Cc1nc(N2CCOC(CF)C2)cc(=O)[nH]1- InChIKey
FRAKRWCAMYUBBF-UHFFFAOYSA-N- Molecular formula
- C13H18FN3O4
- Average molar mass
- 299.3 g/mol
Names & identifiers
- Preferred name
- (+/-)-[4-(2-Fluoromethylmorpholin-4-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]acetic acid ethyl ester
- IUPAC
- ethyl 2-[4-[2-(fluoromethyl)morpholin-4-yl]-6-oxo-1H-pyrimidin-2-yl]acetate
Names & synonyms
SCHEMBL12475684FRAKRWCAMYUBBF-UHFFFAOYSA-N(+/-)-[4-(2-fluoromethylmorpholin-4-yl)-6-oxo-1,6-dihydropyrimidin-2-yl]acetic acid ethyl ester
Database identifiers
- PubChem CID
- 136378682
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 80.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 478
Related reactions
1 records
Compound notes
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