CAS 338751-48-7

2-[[(2-Chloro-6-fluorophenyl)methyl]thio]-7-[1-(2,4-dichlorophenoxy)ethyl][1,2,4]triazolo[1,5-a]pyrimidine

Description:

The chemical substance known as 2-[[(2-Chloro-6-fluorophenyl)methyl]thio]-7-[1-(2,4-dichlorophenoxy)ethyl][1,2,4]triazolo[1,5-a]pyrimidine, with the CAS number 338751-48-7, is a synthetic compound that belongs to the class of triazolopyrimidines. This compound features a complex structure characterized by a triazole ring fused to a pyrimidine moiety, which is further substituted with various functional groups, including a thioether and multiple halogen atoms. The presence of chlorine and fluorine atoms in its structure suggests potential biological activity, as halogenated compounds often exhibit unique pharmacological properties. The compound's thioether linkage may enhance its lipophilicity and influence its interaction with biological targets. Due to its intricate structure, this substance may be of interest in medicinal chemistry, particularly in the development of pharmaceuticals targeting specific diseases. However, detailed studies on its biological activity, toxicity, and pharmacokinetics would be necessary to fully understand its potential applications and safety profile.

Formula: C₂₀H₁₄Cl₃FN₄OS

InChI: InChI=1S/C20H14Cl3FN4OS/c1-11(29-18-6-5-12(21)9-15(18)23)17-7-8-25-19-26-20(27-28(17)19)30-10-13-14(22)3-2-4-16(13)24/h2-9,11H,10H2,1H3

InChI key: InChIKey=PTNVLEQBZBAELP-UHFFFAOYSA-N

SMILES: C(OC1=C(Cl)C=C(Cl)C=C1)(C)C=2N3C(=NC(SCC4=C(Cl)C=CC=C4F)=N3)N=CC2

Synonyms:

• 2-[[(2-Chloro-6-fluorophenyl)methyl]thio]-7-[1-(2,4-dichlorophenoxy)ethyl][1,2,4]triazolo[1,5-a]pyrimidine
• [1,2,4]Triazolo[1,5-a]pyrimidine, 2-[[(2-chloro-6-fluorophenyl)methyl]thio]-7-[1-(2,4-dichlorophenoxy)ethyl]-