N-[1-(1H-Benzotriazol-1-yl)-2,2-dimethylpropyl]-3,4-dimethoxybenzeneacetamide

Base Information

• Chemical Name: N-[1-(1H-Benzotriazol-1-yl)-2,2-dimethylpropyl]-3,4-dimethoxybenzeneacetamide
• CAS No.: 861393-66-0
• Molecular Formula: C21H26N4O3
• Molecular Weight: 382.45614
• Mol file: 861393-66-0.mol

Synonyms:N-[1-(1H-Benzotriazol-1-yl)-2,2-dimethylpropyl]-3,4-dimethoxybenzeneacetamide;N-(1-(1H-benzo[d][1,2,3]triazol-1-yl)-2,2-diMethylpropyl)-2-(3,4-diMethoxyphenyl)acetaMide

Chemical Property of N-[1-(1H-Benzotriazol-1-yl)-2,2-dimethylpropyl]-3,4-dimethoxybenzeneacetamide

Chemical Property:

• PSA: 81.76000
• Density: 1.19
• LogP: 4.19240

Purity/Quality:

NLT 98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of N-[1-(1H-Benzotriazol-1-yl)-2,2-dimethylpropyl]-3,4-dimethoxybenzeneacetamide

There total 4 articles about N-[1-(1H-Benzotriazol-1-yl)-2,2-dimethylpropyl]-3,4-dimethoxybenzeneacetamide 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: 55.0%

1,2,3-Benzotriazole (95-14-7,27556-51-0) + 2-(3,4-dimethoxyphenyl)acetamide (5663-56-9) + pivalaldehyde (630-19-3) → N-(1-(1H-benzo[d][1,2,3]triazol-1-yl)-2,2-dimethylpropyl)-2-(3,4-dimethoxyphenyl)acetamide (861393-66-0)

Guidance literature:

With toluene-4-sulfonic acid; In toluene; for 10h; Reflux;

DOI:10.1021/jm8015848

Reference yield:

3,4-dimethoxyphenylacetyl chloride (10313-60-7) → N-(1-(1H-benzo[d][1,2,3]triazol-1-yl)-2,2-dimethylpropyl)-2-(3,4-dimethoxyphenyl)acetamide (861393-66-0)

Guidance literature:

Multi-step reaction with 2 steps

1.1: ammonia / tetrahydrofuran

2.1: toluene-4-sulfonic acid / toluene / Reflux

2.2: 60 - 65 °C

With ammonia; toluene-4-sulfonic acid; In tetrahydrofuran; toluene;

Reference yield:

(3,4-Dimethoxyphenyl)acetic acid (93-40-3) → N-(1-(1H-benzo[d][1,2,3]triazol-1-yl)-2,2-dimethylpropyl)-2-(3,4-dimethoxyphenyl)acetamide (861393-66-0)

Guidance literature:

Multi-step reaction with 3 steps

1.1: thionyl chloride / dichloromethane

2.1: ammonia / tetrahydrofuran

3.1: toluene-4-sulfonic acid / toluene / Reflux

3.2: 60 - 65 °C

With thionyl chloride; ammonia; toluene-4-sulfonic acid; In tetrahydrofuran; dichloromethane; toluene;

upstream raw materials:

1,2,3-Benzotriazole

2-(3,4-dimethoxyphenyl)acetamide

pivalaldehyde

(3,4-Dimethoxyphenyl)acetic acid

Downstream raw materials:

N-[1-({(cyanoimino)[(2,6-dimethoxy-3-pyridinyl)amino]methyl}amino)-2,2-dimethylpropyl]-2-(3,4-dimethoxyphenyl)acetamide

N-[1-({(cyanoimino)[(5-quinolinyl)amino]methyl}amino)-2,2-dimethylpropyl]-2-(3,4-dimethoxyphenyl)acetamide

N-[1-({(cyanoimino)[(2,5-dimethylphenyl)amino]methyl}amino)-2,2-dimethylpropyl]-2-(3,4-dimethoxyphenyl)acetamide

N-(1-{[[(5-chloro-2-fluorophenyl)amino](cyanoimino)methyl]amino}-2,2-dimethylpropyl)-2-(3,4-dimethoxyphenyl)acetamide

Refernces

• 1、 Perez-Medrano, Arturo,Donnelly-Roberts, Diana L.,Honore, Prisca,Hsieh, Gin C.,Namovic, Marian T.,Peddi, Sridhar,Shuai, Qi,Wang, Ying,Faltynek, Connie R.,Jarvis, Michael F.,Carroll, William A.. "Discovery and biological evaluation of novel cyanoguanidine P2X7 antagonists with analgesic activity in a rat model of neuropathic pain". experimental part. p. 3366 - 3376. Retrieved 2010/04/03.
• 2、 -. "P2X7 antagonists for treating neuropathic pain". Page/Page column 16. . Retrieved 2008/06/13.