30709-67-2

Basic information

• Product Name: 5-METHYL-4-PHENYL-THIAZOL-2-YLAMINE
• Synonyms: 2-amino-5-methyl-4-phenyl-thiazol;TIMTEC-BB SBB009161;2-AMINO-5-METHYL-4-PHENYLTHIAZOLE;2-AMINO-5-METHYL-4-PHENYL-1,3-THIAZOLE;AKOS BBS-00004742;AKOS BC-1558;AKOS B000315;5-METHYL-4-PHENYL-1,3-THIAZOL-2-AMINE
• CAS NO: 30709-67-2
• Molecular Formula: C₁₀H₁₀N₂S
• Molecular Weight: 190.26
• Product Categories: pharmacetical;Amines;Thiazoles, Isothiazoles &Benzothiazoles;Heterocyclic Compounds;Thiazoles, Isothiazoles & Benzothiazoles
• Mol File: 30709-67-2.mol
• Article Data: 28

Chemical Properties

• Melting Point: 122-126 °C
• Boiling Point: 350℃
• Flash Point: 165℃
• Appearance: /
• Density: 1.219
• Vapor Pressure: 4.62E-05mmHg at 25°C
• Refractive Index: 1.642
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• PKA: 4.81±0.10(Predicted)
• CAS DataBase Reference: 5-METHYL-4-PHENYL-THIAZOL-2-YLAMINE(CAS DataBase Reference)
• NIST Chemistry Reference: 5-METHYL-4-PHENYL-THIAZOL-2-YLAMINE(30709-67-2)
• EPA Substance Registry System: 5-METHYL-4-PHENYL-THIAZOL-2-YLAMINE(30709-67-2)

Safety Data

• Hazard Codes: Xn,Xi
• Statements: 22-37/38-41
• Safety Statements: 26-36/37/39
• WGK Germany: 3
• RTECS: XJ2650000
• HazardClass: IRRITANT
• Hazardous Substances Data: 30709-67-2(Hazardous Substances Data)

Usage

General Description

5-Methyl-4-Phenyl-Thiazol-2-Ylamine is an organic compound belonging to the class of thiazoles, which are heterocyclic compounds featuring a five-membered ring of four carbon atoms and a nitrogen atom. Thiazoles are used in the synthesis of various pharmaceutical and agrochemical products. As a chemical entity, 5-Methyl-4-Phenyl-Thiazol-2-Ylamine has not been widely studied, and reliable data on its properties and potential uses are somewhat scarce. It is not currently reported to have significant industrial uses or significant health or environmental effects, but detailed research and experimentations can reveal potential uses and any associated risks.

InChI:InChI=1/C10H10N2S/c1-7-9(12-10(11)13-7)8-5-3-2-4-6-8/h2-6H,1H3,(H2,11,12)

Upstream product

• 333-20-0 potassium thioacyanate 
• 2114-00-3 2-bromo-1-phenyl-1-propanone 
• 40613-14-7 (3-oxo-3-phenyl-propenyl)-triphenyl-phosphonium; chloride 
• 103-65-1 phenylpropane 
• 2142-63-4 1-(3-Bromophenyl)ethanone 
• 64-17-5 ethanol 
• 93-55-0 1-phenyl-propan-1-one 
• 637-50-3 1-phenylpropene 
• 6084-15-7 2-iodo-1-phenylpropan-1-one 
• 17356-08-0 thiourea 
• 87456-64-2 α-tosyloxypropiophenone 
• 81171-43-9 N-(2-Bromo-1-phenylpropylidene)isopropylamine 
• 28241-61-4 ammonia thiocyanic acid 
• 4773-35-7 1-chloro-1-phenylpropan-2-one 

Downstream Products

• 325471-38-3 4-((5-methyl-4-phenylthiazol-2-yl)amino)-4-oxobutanoic acid 
• 905405-17-6 C₁₅H₁₆N₂O₃S 
• 1357471-59-0 N-(4-phenyl-5-methyl-thiazol-2-yl)acrylamide 
• 433305-70-5 2-(benzothiazol-2-ylthio)-N-(5-methyl-4-phenylthiazol-2-yl)acetamide 

Relevant articles and documents

A novel synthesis of 2-imino-4-thiazolines via α-bromoketimines

A novel straightforward synthesis of 2-imino-4-thiazolines has been performed by reaction of α-bromoketimines with potassium thiocyanate in acetonitrile. Contrary to other syntheses of these heterocycles, no side reactions were observed. The structural as

Method for preparing 2-aminothiazole compound

The invention discloses a method for preparing a 2-aminothiazole compound. The method comprises the following steps: in an organic solvent, carrying out a condensation reaction on thiourea representedby a formula (II) and a ketone compound represented by a formula (III) at 50-120 DEG C for 6-24 h under the catalysis of elemental iodine, and after the reaction is finished, carrying out post-treatment on the reaction solution to obtain the 2-aminothiazole compound represented by a formula (I). According to the invention, the method has characteristics of cheap and easily available reaction rawmaterials, mild reaction conditions, simpleness, no requirement of transition metal catalysts and a stoichiometric halogenating reagents and cost reducing, and can be used for synthesizing a series of2-aminothiazole derivatives, and the prepared products can be used as important intermediates for synthesizing thiazole structure-containing drugs or bioactive compounds.

Structure-Based Design of N-(5-Phenylthiazol-2-yl)acrylamides as Novel and Potent Glutathione S-Transferase Omega 1 Inhibitors

Using reported glutathione S-transferase omega 1 (GSTO1-1) cocrystal structures, we designed and synthesized acrylamide-containing compounds that covalently bind to Cys32 on the catalytic site. Starting from a thiazole derivative 10 (GSTO1-1 IC50 = 0.6 μM), compound 18 was synthesized and cocrystallized with GSTO1. Modification on the amide moiety of hit compound 10 significantly increased the GSTO1-1 inhibitory potency. We solved the cocrystal structures of new derivatives, 37 and 44, bearing an amide side chain bound to GSTO1. These new structures showed a reorientation of the phenyl thiazole core of inhibitors, 37 and 44, when compared to 18. Guided by the cocrystal structure of GSTO1:44, analogue 49 was designed, resulting in the most potent GSTO1-1 inhibitor (IC50 = 0.22 ± 0.02 nM) known to date. We believe that our data will form the basis for future studies of developing GSTO1-1 as a new drug target for cancer therapy.