944275-21-2

Basic information

• Product Name: 2-(2-CHLOROPHENYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID
• Synonyms: 2-(2-CHLOROPHENYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID
• CAS NO: 944275-21-2
• Molecular Formula: C₁₀H₆ClNO₂S
• Molecular Weight: 239.67814
• Mol File: 944275-21-2.mol

Chemical Properties

• Melting Point: 192-194
• Appearance: /
• Storage Temp.: 2-8°C
• CAS DataBase Reference: 2-(2-CHLOROPHENYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 2-(2-CHLOROPHENYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID(944275-21-2)
• EPA Substance Registry System: 2-(2-CHLOROPHENYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID(944275-21-2)

Safety Data

• Hazard Codes: Xi
• HazardClass: IRRITANT
• Hazardous Substances Data: 944275-21-2(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
2-(2-Chlorophenyl)-1,3-thiazole-4-carboxylic acid is used as a building block for the synthesis of various drugs and pharmaceuticals. Its unique chemical structure allows for the creation of a wide range of bioactive molecules, making it an essential component in drug discovery and development.
Used in Drug Synthesis:
As a key intermediate, 2-(2-Chlorophenyl)-1,3-thiazole-4-carboxylic acid is used in the synthesis of various therapeutic agents. Its presence in the molecular structure can enhance the pharmacological properties of the resulting compounds, contributing to their efficacy and safety.
Used in Specialty Chemicals and Materials Manufacturing:
Beyond its applications in the pharmaceutical industry, 2-(2-Chlorophenyl)-1,3-thiazole-4-carboxylic acid may also find use in other industrial sectors. Its unique properties can be leveraged in the manufacturing of specialty chemicals and materials, where it can contribute to the development of innovative products with specific applications.

Upstream product

• 132089-36-2 ethyl 2-(2-chlorophenyl)thiazole-4-carboxylate 
• 15717-17-6 2-chlorothiobenzamide 
• 609-66-5 2-chlorobenzamide 
• 1113-59-3 bromopyruvic acid 
• 1311864-08-0 methyl 2-(2-chlorophenyl)thiazole-4-carboxylate 

Relevant articles and documents

Purple acid phosphatase inhibitors as leads for osteoporosis chemotherapeutics

Purple acid phosphatases (PAPs) are metalloenzymes that catalyse the hydrolysis of phosphate esters under acidic conditions. Their active site contains a Fe(III)Fe(II) metal centre in mammals and a Fe(III)Zn(II) or Fe(III)Mn(II) metal centre in plants. In humans, elevated PAP levels in serum strongly correlate with the progression of osteoporosis and metabolic bone malignancies, which make PAP a target suitable for the development of chemotherapeutics to combat bone ailments. Due to difficulties in obtaining the human enzyme, the corresponding enzymes from red kidney bean and pig have been used previously to develop specific PAP inhibitors. Here, existing lead compounds were further elaborated to create a series of inhibitors with Ki values as low as ～30 μM. The inhibition constants of these compounds were of comparable magnitude for pig and red kidney bean PAPs, indicating that relevant binding interactions are conserved. The crystal structure of red kidney bean PAP in complex with the most potent inhibitor in this series, compound 4f, was solved to 2.40 ? resolution. This inhibitor coordinates directly to the binuclear metal centre in the active site as expected based on its competitive mode of inhibition. Docking simulations predict that this compound binds to human PAP in a similar mode. This study presents the first example of a PAP structure in complex with an inhibitor that is of relevance to the development of anti-osteoporotic chemotherapeutics.

Utilization of an Active Site Mutant Receptor for the Identification of Potent and Selective Atypical 5-HT2C Receptor Agonists

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