1026444-42-7

Basic information

• Product Name: 2-(2-m-tolylpropan-2-yl)-1,3,4-oxadiazole
• Synonyms: 2-(2-m-tolylpropan-2-yl)-1,3,4-oxadiazole;2-[1-Methyl-1-(3-methylphenyl)ethyl]-1,3,4-oxadiazole
• CAS NO: 1026444-42-7
• Molecular Formula: C₁₂H₁₄N₂O
• Molecular Weight: 202.25236
• Mol File: 1026444-42-7.mol
• Article Data: 1

Chemical Properties

• Appearance: /
• Density: 1.074
• CAS DataBase Reference: 2-(2-m-tolylpropan-2-yl)-1,3,4-oxadiazole(CAS DataBase Reference)
• NIST Chemistry Reference: 2-(2-m-tolylpropan-2-yl)-1,3,4-oxadiazole(1026444-42-7)
• EPA Substance Registry System: 2-(2-m-tolylpropan-2-yl)-1,3,4-oxadiazole(1026444-42-7)

Safety Data

• Hazardous Substances Data: 1026444-42-7(Hazardous Substances Data)

Usage

General Description

"2-(2-m-Tolylpropan-2-yl)-1,3,4-oxadiazole" is a chemical compound commonly used in various scientific and pharmaceutical research for its unique properties. Its structural formula involves oxadiazole ring, a five-membered aromatic ring containing two nitrogen atoms and one oxygen atom, combined with a 2-methylphenyl group and a propan-2-yl group. Despite limited information on its specific uses and properties from online databases, chemicals similar to this are typically applied in applications such as drug discovery, material science, and chemical biology. Safety, toxicity, and handling information is generally not widely available and should be handled with appropriate care in a laboratory setting.

Upstream product

• 32454-26-5 methyl α-(3-methylphenyl)isobutyrate 
• 122-51-0 orthoformic acid triethyl ester 
• 1027543-64-1 2-methyl-2-m-tolyl-propionic acid hydrazide 

Downstream Products

• 1026841-30-4 [2-(4-fluoro-phenyl)-1-({2-methyl-1-[5-(1-methyl-1-m-tolyl-ethyl)-[1,3,4]oxadiazole-2-carbonyl]-propylcarbamoyl}-methyl)-6-oxo-1,6-dihydro-pyrimidin-5-yl]-carbamic acid benzyl ester 
• 1025995-54-3 {2-(4-fluoro-phenyl)-1-[(1-{hydroxy-[5-(1-methyl-1-m-tolyl-ethyl)-[1,3,4]oxadiazol-2-yl]-methyl}-2-methyl-propylcarbamoyl)-methyl]-6-oxo-1,6-dihydro-pyrimidin-5-yl}-carbamic acid benzyl ester 
• 1027494-17-2 (1-{hydroxy-[5-(1-methyl-1-m-tolyl-ethyl)-[1,3,4]oxadiazol-2-yl]-methyl}-2-methyl-propyl)-carbamic acid tert-butyl ester 

Relevant articles and documents

Development of orally active nonpeptidic inhibitors of human neutrophil elastase

5-Amino-2-phenylpyrimidin-6-ones, some of their desamino derivatives, and miscellaneous derivatives were synthesized and biologically evaluated on both in vitro activity and oral activity in an acute hemorrhagic assay. These compounds contained an α-keto-1,3,4-oxadiazole moiety to bind covalently to the Ser-195 hydroxy group of human neutrophil elastase (HNE). Among those tested, compounds 11a-c,e,i-l(F), 11d,e,k(H), 21d,e,k(F), and 21d,e(H) showed a good oral profile. RS-Mixture 3(H) was selected for clinical evaluation based on its oral potency, duration of action, enzyme selectivity, safety profile, and ease of synthesis. Structure -activity relationships (SARs) are discussed.