CAS 854357-38-3

2,4-Dimethyl 5-[(2-chloroacetyl)amino]-3-(2-methoxy-2-oxoethyl)-2,4-thiophenedicarboxylate

Description:

2,4-Dimethyl 5-[(2-chloroacetyl)amino]-3-(2-methoxy-2-oxoethyl)-2,4-thiophenedicarboxylate is a complex organic compound characterized by its thiophene core, which is a five-membered aromatic ring containing sulfur. This substance features multiple functional groups, including carboxylate esters and an amide, which contribute to its chemical reactivity and potential biological activity. The presence of the chloroacetyl group suggests it may have applications in medicinal chemistry, possibly as a precursor for drug synthesis or as a bioactive molecule. The methoxy and oxoethyl substituents enhance its solubility and may influence its pharmacokinetic properties. Additionally, the dimethyl groups on the thiophene ring can affect the compound's electronic properties and steric hindrance, which are crucial for its interaction with biological targets. Overall, this compound's unique structure and functional groups make it a subject of interest in various fields, including pharmaceuticals and agrochemicals. However, specific safety and handling information should be consulted from reliable sources due to the presence of chlorine and other reactive groups.

Formula: C₁₃H₁₄ClNO₇S

InChI: InChI=1S/C13H14ClNO7S/c1-20-8(17)4-6-9(12(18)21-2)11(15-7(16)5-14)23-10(6)13(19)22-3/h4-5H2,1-3H3,(H,15,16)

InChI key: InChIKey=WTBGOLIAWJFKPS-UHFFFAOYSA-N

SMILES: C(OC)(=O)C=1C(CC(OC)=O)=C(C(OC)=O)SC1NC(CCl)=O

Synonyms:

• 2,4-Thiophenedicarboxylic acid, 5-[(2-chloroacetyl)amino]-3-(2-methoxy-2-oxoethyl)-, 2,4-dimethyl ester
• 2,4-Dimethyl 5-[(2-chloroacetyl)amino]-3-(2-methoxy-2-oxoethyl)-2,4-thiophenedicarboxylate
• 2,4-Thiophenedicarboxylic acid, 5-[(chloroacetyl)amino]-3-(2-methoxy-2-oxoethyl)-, dimethyl ester