CAS 731827-19-3

2,3-Dihydro-3-(3-methylbutyl)-5-(2-thienyl)-2-thioxothieno[2,3-d]pyrimidin-4(1H)-one

Description:

2,3-Dihydro-3-(3-methylbutyl)-5-(2-thienyl)-2-thioxothieno[2,3-d]pyrimidin-4(1H)-one is a complex organic compound characterized by its unique thieno-pyrimidine structure, which incorporates both thienyl and thioxo functional groups. This compound typically exhibits properties such as moderate solubility in organic solvents and potential bioactivity, making it of interest in medicinal chemistry. The presence of the thienyl group may contribute to its electronic properties and reactivity, while the thioxo group can influence its chemical stability and interactions with biological targets. The compound's molecular structure suggests potential applications in pharmaceuticals, particularly in the development of novel therapeutic agents. Its synthesis and characterization would involve standard organic chemistry techniques, including purification methods like chromatography. As with many compounds in this class, understanding its reactivity and biological activity would require further investigation through experimental studies. Safety and handling precautions should be observed due to the potential toxicity associated with thieno- and pyrimidine-based compounds.

Formula: C₁₅H₁₆N₂OS₃

InChI: InChI=1S/C15H16N2OS3/c1-9(2)5-6-17-14(18)12-10(11-4-3-7-20-11)8-21-13(12)16-15(17)19/h3-4,7-9H,5-6H2,1-2H3,(H,16,19)

InChI key: InChIKey=JWSABAQZQJSWGW-UHFFFAOYSA-N

SMILES: O=C1C=2C(=CSC2NC(=S)N1CCC(C)C)C3=CC=CS3

Synonyms:

• 2,3-Dihydro-3-(3-methylbutyl)-5-(2-thienyl)-2-thioxothieno[2,3-d]pyrimidin-4(1H)-one
• Thieno[2,3-d]pyrimidin-4(1H)-one, 2,3-dihydro-3-(3-methylbutyl)-5-(2-thienyl)-2-thioxo-

3-(3-Methylbutyl)-2-sulfanyl-5-(thiophen-2-yl)-3H,4H-thieno[2,3-d]pyrimidin-4-one

CAS: 731827-19-3

Versatile small molecule scaffold

Formula: C₁₅H₁₆N₂OS₃

Purity: Min. 95%

Molecular weight: 336.5 g/mol

Ref: 3D-GEB82719