3-Methyl[1,3]thiazolo[3,2-a]benzimidazole

Base Information

• Chemical Name: 3-Methyl[1,3]thiazolo[3,2-a]benzimidazole
• CAS No.: 5268-73-5
• Molecular Formula: C10H8N2S
• Molecular Weight: 188.253
• Hs Code.: 2934100090
• DSSTox Substance ID: DTXSID30356668
• Nikkaji Number: J1.138.613J
• Wikidata: Q82136173
• Mol file: 5268-73-5.mol

Synonyms:3-methyl[1,3]thiazolo[3,2-a]benzimidazole;5268-73-5;1-methyl-[1,3]thiazolo[3,2-a]benzimidazole;3-methylthiazolo[3,2-a]benzimidazole;SCHEMBL2776006;DTXSID30356668;NAVVCVXQHMJHJA-UHFFFAOYSA-N;3-Methylthiazolo[3,2-a]benzoimidazole;AE-848/36048063

Chemical Property of 3-Methyl[1,3]thiazolo[3,2-a]benzimidazole

Chemical Property:

• PSA: 45.54000
• LogP: 2.85740
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 188.04081944
• Heavy Atom Count: 13
• Complexity: 209

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CSC2=NC3=CC=CC=C3N12

Technology Process of 3-Methyl[1,3]thiazolo[3,2-a]benzimidazole

There total 15 articles about 3-Methyl[1,3]thiazolo[3,2-a]benzimidazole which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 97.0%

2-(decylthio)-4-methyl-3-(2-(3-phenylureido)phenyl)thiazol-3-ium iodide (1220704-76-6) → 3-methylthiazolo[3,2-a]benzoimidazole (5268-73-5) + S-(decyl) phenylcarbamothioate

Guidance literature:

With triethylamine; In acetonitrile; at 20 ℃; for 0.25h;

DOI:10.1016/j.tet.2010.01.020

Reference yield: 96.0%

4-methyl-2-(methylthio)-3-(2-(3-(4-nitrophenyl)ureido)-phenyl)thiazol-3-ium iodide (1220704-70-0) → 3-methylthiazolo[3,2-a]benzoimidazole (5268-73-5) + S-methyl (4-nitrophenyl)carbamothioate (34277-69-5)

Guidance literature:

With triethylamine; In acetonitrile; at 20 ℃; for 0.25h;

DOI:10.1016/j.tet.2010.01.020

Reference yield: 96.0%

3-(2-(3-(3,5-bis(trifluoromethyl)benzyl)ureido)phenyl)-4-methyl-2-(methylthio)thiazol-3-ium iodide (1220704-71-1) → 3-methylthiazolo[3,2-a]benzoimidazole (5268-73-5) + S-methyl 3,5-bis(trifluoromethyl)benzylcarbamothioate (1220704-79-9)

Guidance literature:

With triethylamine; In acetonitrile; at 20 ℃; for 0.25h;

DOI:10.1016/j.tet.2010.01.020

upstream raw materials:

4-methyl-2-(methylthio)-3-(2-(3-phenylureido)phenyl)thiazol-3-iumiodide

2-(decylthio)-4-methyl-3-(2-(3-p-tolylureido)phenyl)thiazol-3-ium iodide

4-methyl-2-(methylthio)-3-(2-(3-p-tolylureido)phenyl)thiazol-3-ium iodide

3-(2-(3-(3,5-bis(trifluoromethyl)phenyl)ureido)phenyl)-4-methyl-2-(methylthio)thiazol-3-ium iodide

Downstream raw materials:

2-(1,2-propadienylthio)benzimidazole

3-Methyl-thiazolo<3,2-a>benzimidazol-2-carbonsaeure

C₁₇H₁₈N₂OS

9-benzyl-3-methyl[1,3]thiazolo[3,2-a]benzimidazol-9-ium chloride