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CAS 75838-24-3

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5-Cyano-1-[3-(trifluoromethyl)phenyl]uracil

Description:
5-Cyano-1-[3-(trifluoromethyl)phenyl]uracil, with the CAS number 75838-24-3, is a synthetic organic compound that belongs to the class of uracil derivatives. This substance features a uracil core, which is a pyrimidine base, modified by the presence of a cyano group at the 5-position and a trifluoromethyl-substituted phenyl group at the 1-position. The trifluoromethyl group enhances the lipophilicity and biological activity of the compound, making it of interest in medicinal chemistry, particularly in the development of antiviral and anticancer agents. The cyano group contributes to the compound's reactivity and potential for further chemical modifications. In terms of physical properties, it is typically a solid at room temperature, with solubility characteristics that may vary depending on the solvent used. The compound's unique structure allows for specific interactions with biological targets, which is crucial for its potential therapeutic applications. As with many fluorinated compounds, it may exhibit distinct pharmacokinetic properties, influencing its efficacy and safety profile in biological systems.
Formula:C12H6F3N3O2
InChI:InChI=1/C12H6F3N3O2/c13-12(14,15)8-2-1-3-9(4-8)18-6-7(5-16)10(19)17-11(18)20/h1-4,6H,(H,17,19,20)
SMILES:c1cc(cc(c1)n1cc(C#N)c(nc1=O)O)C(F)(F)F
Synonyms:
  • Cyanotrifluoromethylphenyluracil
  • 1,1,1-Trichloro-3,3,3-Trifluoropropan-2-One
  • 2,4-Dioxo-1-[3-(Trifluoromethyl)Phenyl]-1,2,3,4-Tetrahydropyrimidine-5-Carbonitrile
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