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CAS 1858250-86-8

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6-[2-Methyl-6-(trifluoromethyl)-3-pyridinyl]-2(1H)-pyrimidinethione

Description:
6-[2-Methyl-6-(trifluoromethyl)-3-pyridinyl]-2(1H)-pyrimidinethione is a chemical compound characterized by its complex structure, which includes a pyrimidinethione core and a pyridine ring substituted with a methyl and a trifluoromethyl group. This compound is notable for its potential biological activity, particularly in medicinal chemistry, where it may serve as a lead compound for the development of pharmaceuticals. The presence of the trifluoromethyl group enhances lipophilicity and metabolic stability, which can influence the compound's pharmacokinetic properties. Additionally, the thione functional group may participate in various chemical reactions, including nucleophilic attacks and coordination with metal ions. Its molecular structure suggests potential interactions with biological targets, making it of interest in drug discovery and development. As with many compounds in this category, safety and handling precautions are essential due to potential toxicity or reactivity. Further studies would be necessary to fully elucidate its properties and applications in various fields, including agrochemicals and pharmaceuticals.
Formula:C11H8F3N3S
InChI:InChI=1S/C11H8F3N3S/c1-6-7(8-4-5-15-10(18)17-8)2-3-9(16-6)11(12,13)14/h2-5H,1H3,(H,15,17,18)
InChI key:InChIKey=QBIIIRUPWJAHDS-UHFFFAOYSA-N
SMILES:CC1=C(C=2NC(=S)N=CC2)C=CC(C(F)(F)F)=N1
Synonyms:
  • 6-[2-Methyl-6-(trifluoromethyl)-3-pyridinyl]-2(1H)-pyrimidinethione
  • 2(1H)-Pyrimidinethione, 6-[2-methyl-6-(trifluoromethyl)-3-pyridinyl]-
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