CAS 2223-96-3

Ethyl 4-chloro-2-(ethylthio)-5-pyrimidinecarboxylate

Description:

Ethyl 4-chloro-2-(ethylthio)-5-pyrimidinecarboxylate, with the CAS number 2223-96-3, is a chemical compound that belongs to the class of pyrimidine derivatives. It features a pyrimidine ring substituted with a chloro group and an ethylthio group, as well as an ethyl ester functional group. This compound is typically characterized by its moderate solubility in organic solvents and limited solubility in water, which is common for many pyrimidine derivatives. The presence of the chloro and ethylthio substituents can influence its reactivity and biological activity, making it of interest in medicinal chemistry and agrochemical applications. Ethyl 4-chloro-2-(ethylthio)-5-pyrimidinecarboxylate may exhibit various pharmacological properties, potentially acting as an intermediate in the synthesis of more complex molecules. Its structural features suggest potential interactions with biological targets, which could be explored in drug development or agricultural chemistry. As with any chemical, proper handling and safety precautions should be observed due to potential toxicity or reactivity.

Formula: C₉H₁₁ClN₂O₂S

InChI: InChI=1S/C9H11ClN2O2S/c1-3-14-8(13)6-5-11-9(15-4-2)12-7(6)10/h5H,3-4H2,1-2H3

InChI key: InChIKey=LHLXRHNNXBXIBM-UHFFFAOYSA-N

SMILES: C(OCC)(=O)C=1C(Cl)=NC(SCC)=NC1

Synonyms:

• NSC 122025
• 5-Pyrimidinecarboxylic acid, 4-chloro-2-(ethylthio)-, ethyl ester
• Ethyl 4-chloro-2-(ethylthio)-5-pyrimidinecarboxylate
• 2-Ethylthio-4-chloro-5-(ethoxycarbonyl)pyrimidine

Ethyl 4-chloro-2-(ethylthio)pyrimidine-5-carboxylate

CAS: 2223-96-3

Formula: C₉H₁₁ClN₂O₂S

Molecular weight: 246.7138

Ref: IN-DA00BI66

Ethyl 4-chloro-2-(ethylthio)pyrimidine-5-carboxylate

CAS: 2223-96-3

Ethyl 4-chloro-2-(ethylthio)pyrimidine-5-carboxylate is an inhibitor of the enzyme acetylcholinesterase. It is a ligand for nicotinic acetylcholine receptors and has been shown to activate the ion channel TRPV1, which is involved in pain sensation. The compound also inhibits serine proteases and phospholipases. This chemical has been used as a research tool in cell biology, pharmacology, and life sciences.

Formula: C₉H₁₁ClN₂O₂S

Purity: Min. 95%

Molecular weight: 246.71 g/mol

Ref: 3D-CAA22396