CAS 1134334-61-4

Methyl 5-chloro-3-[(2-chloroacetyl)amino]-1H-indole-2-carboxylate

Description:

Methyl 5-chloro-3-[(2-chloroacetyl)amino]-1H-indole-2-carboxylate is a synthetic organic compound characterized by its indole structure, which is a bicyclic compound consisting of a benzene ring fused to a pyrrole ring. This compound features a methyl ester functional group, a chloro substituent, and an acetamido group, contributing to its reactivity and potential biological activity. The presence of the chloroacetyl moiety suggests that it may participate in nucleophilic substitution reactions, making it of interest in medicinal chemistry. Its indole framework is often associated with various pharmacological properties, including anti-inflammatory and anticancer activities. The compound's solubility, stability, and reactivity can be influenced by the presence of the chlorine atoms and the ester group. As with many indole derivatives, it may exhibit interactions with biological targets, making it a candidate for further research in drug development. Safety and handling precautions should be observed due to the presence of chlorine, which can pose health risks.

Formula: C₁₂H₁₀Cl₂N₂O₃

InChI: InChI=1S/C12H10Cl2N2O3/c1-19-12(18)11-10(16-9(17)5-13)7-4-6(14)2-3-8(7)15-11/h2-4,15H,5H2,1H3,(H,16,17)

InChI key: InChIKey=UIJPQDJNBYSPGM-UHFFFAOYSA-N

SMILES: N(C(CCl)=O)C=1C=2C(NC1C(OC)=O)=CC=C(Cl)C2

Synonyms:

• Methyl 5-chloro-3-[(2-chloroacetyl)amino]-1H-indole-2-carboxylate
• 1H-Indole-2-carboxylic acid, 5-chloro-3-[(2-chloroacetyl)amino]-, methyl ester