50483-77-7

Basic information

• Product Name: 3-METHYL-5-PHENYL-1,2,4-THIADIAZOLE
• Synonyms: 3-METHYL-5-PHENYL-1,2,4-THIADIAZOLE;1,2,4-Thiadiazole, 3-Methyl-5-phenyl-
• CAS NO: 50483-77-7
• Molecular Formula: C₉H₈N₂S
• Molecular Weight: 176.24
• Mol File: 50483-77-7.mol
• Article Data: 4

Chemical Properties

• Melting Point: 50 °C
• Boiling Point: 309.6°C at 760 mmHg
• Flash Point: 139.6°C
• Appearance: /
• Density: 1.199g/cm³
• Vapor Pressure: 0.00115mmHg at 25°C
• Refractive Index: 1.599
• CAS DataBase Reference: 3-METHYL-5-PHENYL-1,2,4-THIADIAZOLE(CAS DataBase Reference)
• NIST Chemistry Reference: 3-METHYL-5-PHENYL-1,2,4-THIADIAZOLE(50483-77-7)
• EPA Substance Registry System: 3-METHYL-5-PHENYL-1,2,4-THIADIAZOLE(50483-77-7)

Safety Data

• Hazardous Substances Data: 50483-77-7(Hazardous Substances Data)

Usage

General Description

3-METHYL-5-PHENYL-1,2,4-THIADIAZOLE is a chemical compound with the molecular formula C9H8N2S. It belongs to the class of thiadiazole compounds, which are commonly used in pharmaceuticals and agrochemicals due to their diverse biological activities. 3-METHYL-5-PHENYL-1,2,4-THIADIAZOLE is known for its potential pharmacological properties, including its antiviral, antifungal, and antimicrobial activities. It is also used as a building block in the synthesis of various medicinally important compounds. This chemical has garnered interest in the scientific community for its potential in drug discovery and development.

InChI:InChI=1/C9H8N2S/c1-7-10-9(12-11-7)8-5-3-2-4-6-8/h2-6H,1H3

Upstream product

• 100-47-0 benzonitrile 
• 17452-74-3 5-Methyl-1,3,4-oxathiazole-2-one 
• 67229-59-8 N-<1-(Dimethylamino)ethylidene>thiobenzamide 
• 2227-79-4 benzenecarbothioamide 
• 75-05-8 acetonitrile 
• 67229-59-8 N¹,N¹-dimethyl-N²-thiobenzoylacetamidine 

Downstream Products

• 3599-61-9 4,6-dimethyl-2-phenyl-{1,3,5}triazine 
• 3599-62-0 2-methyl-4,6-diphenyl-1,3,5-triazine 
• 100-47-0 benzonitrile 
• 90418-03-4 5-methyl-3-phenyl-1,2,4-thiadiazole 
• 1068104-32-4 3-bromomethyl-5-phenyl-1,2,4-thiadiazole 

Relevant articles and documents

One-pot synthesis of 3,5-disubstituted 1,2,4-thiadiazoles from nitriles and thioamides: Via I2-mediated oxidative formation of an N-S bond

A simple and practical method for I2-mediated one-pot synthesis of 3-alkyl-5-aryl-1,2,4-thiadiazoles has been developed; the one-pot reaction includes sequential intermolecular addition of thioamides to nitriles, and intramolecular oxidative coupling of N-H and S-H bonds mediated by molecular iodine. Meanwhile the protocol uses readily available nitriles and thioamides as the starting materials, molecular iodine as the oxidant, and generates various 1,2,4-thiadiazoles in moderate to good yields with a wide array of functional groups. This method is an efficient approach for the synthesis of unsymmetrically disubstituted 1,2,4-thiadiazoles.

Non-ATP competitive glycogen synthase kinase 3β (GSK-3β) inhibitors: Study of structural requirements for thiadiazolidinone derivatives

The 2,4-disubstituted thiadiazolidinones (TDZD) were described as the first non-ATP competitive GSK-3β inhibitors. New modifications in this heterocyclic ring are here reported to study the influence on the biological activity. The basic skeleton of 1,2,4-thiadiazole and also one of the carbonyl groups are kept, while different modifications are introduced in positions 3 and 5, respectively. The GSK-3β activity of the new thiadiazole derivatives here synthesized showed IC50 values for some of the compounds in the micromolar range. Additionally, ATP competition studies have been carried out, showing that as well as the first generation of TDZD, these new compounds act in a non-competitive manner. With this study, additional requirements for the biological activity of the TDZD family have been delineated.