Ethyl 1,6-dihydro-2-(2-fluoroanilino)-6-oxo-5-pyrimidinecarboxylate

HCID 13562811
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Basic information

Standard SMILES
CCOC(=O)c1cnc(Nc2ccccc2F)[nH]c1=O
InChIKey
LYRKWDVPDLRLDS-UHFFFAOYSA-N
Molecular formula
C13H12FN3O3
Average molar mass
277.25 g/mol
Monoisotopic mass
277.08626942

Names & identifiers

Preferred name
Ethyl 1,6-dihydro-2-(2-fluoroanilino)-6-oxo-5-pyrimidinecarboxylate
IUPAC
ethyl 2-(2-fluoroanilino)-6-oxo-1H-pyrimidine-5-carboxylate

Names & synonyms

SCHEMBL10784043LYRKWDVPDLRLDS-UHFFFAOYSA-Nethyl 1,6-dihydro-2-(2-fluoroanilino)-6-oxo-5-pyrimidinecarboxylate

Database identifiers

PubChem CID
13562811

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
79.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
20

Related reactions

4 records
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Compound notes

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