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CAS 149771-09-5

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Ethyl 2-amino-4-(trifluoromethyl)-5-pyrimidinecarboxylate

Description:
Ethyl 2-amino-4-(trifluoromethyl)-5-pyrimidinecarboxylate is a chemical compound characterized by its pyrimidine ring structure, which is a six-membered aromatic ring containing two nitrogen atoms at positions 1 and 3. The presence of a trifluoromethyl group at the 4-position significantly influences its chemical properties, enhancing lipophilicity and potentially affecting its biological activity. The ethyl ester functional group contributes to its reactivity, making it amenable to hydrolysis and other chemical transformations. This compound is often studied for its potential applications in pharmaceuticals, particularly in the development of drugs targeting various biological pathways. Its amino group at the 2-position may participate in hydrogen bonding, influencing solubility and interaction with biological targets. Overall, the unique combination of functional groups and the pyrimidine core makes this compound of interest in medicinal chemistry and related fields.
Formula:C8H8F3N3O2
InChI:InChI=1S/C8H8F3N3O2/c1-2-16-6(15)4-3-13-7(12)14-5(4)8(9,10)11/h3H,2H2,1H3,(H2,12,13,14)
InChI key:InChIKey=OUACXMUEZBQRBJ-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C=1C(C(F)(F)F)=NC(N)=NC1
Synonyms:
  • Ethyl 2-amino-4-(trifluoromethyl)-5-pyrimidinecarboxylate
  • 5-Pyrimidinecarboxylic acid, 2-amino-4-(trifluoromethyl)-, ethyl ester
  • 2-Amino-4-trifluoromethylpyrimidine-5-carboxylic acid ethyl ester
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