N-(5-((4-(Hydroxy(oxido)amino)phenyl)thio)-1,3-thiazol-2-yl)acetamide

Base Information

• Chemical Name: N-(5-((4-(Hydroxy(oxido)amino)phenyl)thio)-1,3-thiazol-2-yl)acetamide
• CAS No.: 7254-13-9
• Molecular Formula: C11H9N3O3S2
• Molecular Weight: 295.3375
• Hs Code.: 2934100090
• European Community (EC) Number: 635-283-5
• NSC Number: 72988
• DSSTox Substance ID: DTXSID70222853
• Nikkaji Number: J24.659J
• Wikidata: Q83101202
• ChEMBL ID: CHEMBL1882790
• Mol file: 7254-13-9.mol

Synonyms:7254-13-9;N-(5-((4-(Hydroxy(oxido)amino)phenyl)thio)-1,3-thiazol-2-yl)acetamide;N-[5-(4-nitrophenyl)sulfanyl-1,3-thiazol-2-yl]acetamide;NSC72988;NSC 72988;MLS002693803;AIDS-125459;N-{5-[(4-nitrophenyl)sulfanyl]-1,3-thiazol-2-yl}acetamide;Oprea1_006623;SCHEMBL9426507;CHEMBL1882790;DTXSID70222853;YKTLZNQOOIRKMH-UHFFFAOYSA-N;HMS3085I04;NSC-72988;AKOS024323079;SMR001559744;2-acetylamino-5-(4-nitrophenylthio)thiazole;N-[5-(4-nitrophenyl)sulfanylthiazol-2-yl]acetamide

Chemical Property of N-(5-((4-(Hydroxy(oxido)amino)phenyl)thio)-1,3-thiazol-2-yl)acetamide

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 141.35000
• Density: 1.5g/cm³
• LogP: 3.75710
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 295.00853350
• Heavy Atom Count: 19
• Complexity: 343

Purity/Quality:

99%min ^*data from raw suppliers

2-ACETAMIDO-5-(4-NITROPHENYLTHIO)THIAZOLE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(=O)NC1=NC=C(S1)SC2=CC=C(C=C2)[N+](=O)[O-]

Technology Process of N-(5-((4-(Hydroxy(oxido)amino)phenyl)thio)-1,3-thiazol-2-yl)acetamide

There total 9 articles about N-(5-((4-(Hydroxy(oxido)amino)phenyl)thio)-1,3-thiazol-2-yl)acetamide 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:

N-(5-chlorothiazol-2-yl)acetamide (20256-39-7) + para-nitrobenzenethiol (1849-36-1) → N-[5-(4-nitro-phenylsulfanyl)-thiazol-2-yl]-acetamide (7254-13-9)

Guidance literature:

With potassium carbonate; In hexane; ethyl acetate; N,N-dimethyl-formamide;

Reference yield:

2-thiazolylamine (96-50-4) + 4-nitrobenzenesulfenyl chloride (937-32-6) → N-[5-(4-nitro-phenylsulfanyl)-thiazol-2-yl]-acetamide (7254-13-9)

Guidance literature:

With acetic anhydride;

DOI:10.1021/ja01220a049

Reference yield:

5-(4-nitro-phenylsulfanyl)-thiazol-2-ylamine (133691-55-1) → N-[5-(4-nitro-phenylsulfanyl)-thiazol-2-yl]-acetamide (7254-13-9)

Guidance literature:

With acetic anhydride;

upstream raw materials:

2-thiazolylamine

4-nitrobenzenesulfenyl chloride

2-acetamidothiazole

4-nitro-benzenesulfinyl chloride

Downstream raw materials:

5-(4-nitro-phenylsulfanyl)-thiazol-2-ylamine

2-acetylamino-5-(4-aminophenylthio)thiazole

Refernces