CAS 866049-12-9

4-[(4-Methylphenyl)thio]-2-(methylthio)thieno[3,2-d]pyrimidine

Description:

4-[(4-Methylphenyl)thio]-2-(methylthio)thieno[3,2-d]pyrimidine is a heterocyclic compound characterized by its complex structure, which includes a thieno[3,2-d]pyrimidine core. This compound features a thioether functional group, indicated by the presence of sulfur atoms in its structure, contributing to its chemical reactivity and potential biological activity. The presence of the 4-methylphenyl and methylthio substituents enhances its lipophilicity, which may influence its solubility and permeability in biological systems. Such compounds are often investigated for their pharmacological properties, including potential roles as kinase inhibitors or in other therapeutic applications. The molecular structure suggests that it may exhibit interesting electronic properties due to the conjugation within the heterocyclic ring system. Additionally, the compound's stability, reactivity, and interactions with biological targets can be influenced by the arrangement of its substituents, making it a subject of interest in medicinal chemistry and drug design.

Formula: C₁₄H₁₂N₂S₃

InChI: InChI=1S/C14H12N2S3/c1-9-3-5-10(6-4-9)19-13-12-11(7-8-18-12)15-14(16-13)17-2/h3-8H,1-2H3

InChI key: InChIKey=OJGSZQMSEJMLKK-UHFFFAOYSA-N

SMILES: S(C1=C2C(=NC(SC)=N1)C=CS2)C3=CC=C(C)C=C3

Synonyms:

• 4-[(4-Methylphenyl)thio]-2-(methylthio)thieno[3,2-d]pyrimidine
• Thieno[3,2-d]pyrimidine, 4-[(4-methylphenyl)thio]-2-(methylthio)-