Acetamide, N-[3-[2-(4-bromophenyl)-2-oxoethyl]-2(3H)-thiazolylidene]-

Base Information

• Chemical Name: Acetamide, N-[3-[2-(4-bromophenyl)-2-oxoethyl]-2(3H)-thiazolylidene]-
• CAS No.: 62284-55-3
• Molecular Formula: C₁₃H₁₁BrN₂O₂S
• Molecular Weight: 339.213
• DSSTox Substance ID: DTXSID80398871
• ChEMBL ID: CHEMBL3302324

Synonyms:62284-55-3;Acetamide, N-[3-[2-(4-bromophenyl)-2-oxoethyl]-2(3H)-thiazolylidene]-;Oprea1_048353;CHEMBL3302324;DTXSID80398871;MFCD00433133;AKOS001324792;AKOS030648513;EU-0040434;Z234853634

Chemical Property of Acetamide, N-[3-[2-(4-bromophenyl)-2-oxoethyl]-2(3H)-thiazolylidene]-

Chemical Property:

• PSA: 79.67000
• LogP: 2.64220
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 337.97246
• Heavy Atom Count: 19
• Complexity: 428

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)N=C1N(C=CS1)CC(=O)C2=CC=C(C=C2)Br

Technology Process of Acetamide, N-[3-[2-(4-bromophenyl)-2-oxoethyl]-2(3H)-thiazolylidene]-

There total 2 articles about Acetamide, N-[3-[2-(4-bromophenyl)-2-oxoethyl]-2(3H)-thiazolylidene]- 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:

para-bromophenacyl bromide (99-73-0,132309-76-3) → 2-(2-acetylimino-thiazol-3-yl)-1-(4-bromo-phenyl)-ethanone (62284-55-3)

Guidance literature:

Multi-step reaction with 2 steps

1: propan-2-ol / 1 h / Heating

2: Py / 1.5 h / Heating

With pyridine; In isopropyl alcohol;

DOI:10.1021/jm00214a021

Reference yield:

acetic anhydride (108-24-7) + 1-(4-bromo-phenyl)-2-(2-imino-thiazol-3-yl)-ethanone (62284-52-0) → 2-(2-acetylimino-thiazol-3-yl)-1-(4-bromo-phenyl)-ethanone (62284-55-3)

Guidance literature:

With pyridine; for 1.5h; Heating;

DOI:10.1021/jm00214a021

Reference yield:

2-(2-acetylimino-thiazol-3-yl)-1-(4-bromo-phenyl)-ethanone (62284-55-3) → 2-(2-acetylimino-thiazol-3-yl)-1-(4-bromo-phenyl)-ethanol (62284-59-7)

Guidance literature:

With sodium tetrahydroborate; In methanol; for 2h; Ambient temperature;

DOI:10.1021/jm00214a021

upstream raw materials:

acetic anhydride

1-(4-bromo-phenyl)-2-(2-imino-thiazol-3-yl)-ethanone

para-bromophenacyl bromide

Downstream raw materials:

2-(2-acetylimino-thiazol-3-yl)-1-(4-bromo-phenyl)-ethanol

6-(4-bromo-phenyl)-5,6-dihydro-imidazo[2,1-b]thiazole

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