CAS 794582-31-3

4-Chloro-2-[[(4-chlorophenyl)thio]methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine

Description:

4-Chloro-2-[[(4-chlorophenyl)thio]methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine is a synthetic organic compound characterized by its complex structure, which includes a benzothieno-pyrimidine core. This compound features a chloro substituent and a thioether linkage, contributing to its unique chemical properties. It is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. The presence of the chloro and thio groups can influence its reactivity, making it potentially useful in medicinal chemistry, particularly in the development of pharmaceuticals. The compound may also demonstrate biological activity, which is often assessed through various in vitro and in vivo studies. Its molecular structure suggests potential interactions with biological targets, making it a candidate for further research in drug discovery. As with many synthetic compounds, safety and handling precautions should be observed due to potential toxicity or reactivity.

Formula: C₁₇H₁₄Cl₂N₂S₂

InChI: InChI=1S/C17H14Cl2N2S2/c18-10-5-7-11(8-6-10)22-9-14-20-16(19)15-12-3-1-2-4-13(12)23-17(15)21-14/h5-8H,1-4,9H2

InChI key: InChIKey=GSDJPPPIGUQAPO-UHFFFAOYSA-N

SMILES: ClC1=C2C(SC3=C2CCCC3)=NC(CSC4=CC=C(Cl)C=C4)=N1

Synonyms:

• 4-Chloro-2-[[(4-chlorophenyl)thio]methyl]-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
• [1]Benzothieno[2,3-d]pyrimidine, 4-chloro-2-[[(4-chlorophenyl)thio]methyl]-5,6,7,8-tetrahydro-

3-Chloro-5-{[(4-chlorophenyl)sulfanyl]methyl}-8-thia-4,6-diazatricyclo[7.4.0.0,2,7]trideca-1(9),2,4,6-tetraene

CAS: 794582-31-3

Versatile small molecule scaffold

Formula: C₁₇H₁₄Cl₂N₂S₂

Purity: Min. 95%

Molecular weight: 381.3 g/mol

Ref: 3D-UGB58231