4-(2-chloro-5-fluoropyriMidin-4-ylaMino)-N-(2-chlorophenyl)benzaMide

Base Information

• Chemical Name: 4-(2-chloro-5-fluoropyriMidin-4-ylaMino)-N-(2-chlorophenyl)benzaMide
• CAS No.: 1158838-41-5
• Molecular Formula: C17H11Cl2FN4O
• Molecular Weight: 377.205
• Mol file: 1158838-41-5.mol

Synonyms:4-(2-chloro-5-fluoropyriMidin-4-ylaMino)-N-(2-chlorophenyl)benzaMide;4-[(2-Chloro-5-fluoro-4-pyrimidinyl)amino]-N-(2-chlorophenyl)benzamide

Chemical Property of 4-(2-chloro-5-fluoropyriMidin-4-ylaMino)-N-(2-chlorophenyl)benzaMide

Chemical Property:

• PSA: 66.91000
• LogP: 5.06440

Purity/Quality:

98%min ^*data from raw suppliers

4-(2-Chloro-5-fluoropyrimidin-4-ylamino)-N-(2-chlorophenyl)benzamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4-(2-chloro-5-fluoropyriMidin-4-ylaMino)-N-(2-chlorophenyl)benzaMide

There total 4 articles about 4-(2-chloro-5-fluoropyriMidin-4-ylaMino)-N-(2-chlorophenyl)benzaMide 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: 89.0%

4-amino-N-(2-chlorophenyl)benzamide (888-79-9) + 2,4-dichloro-5-fluoropyrimidine (2927-71-1) → 4-((2-chloro-5-fluoropyrimidin-4-yl)amino)-N-(2-chlorophenyl)benzamide (1158838-41-5)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In methanol; at 70 ℃; for 72h;

DOI:10.1021/jm9000314

Reference yield:

4-(N-tert-butoxycarbonyl)aminobenzoic acid (66493-39-8) → 4-((2-chloro-5-fluoropyrimidin-4-yl)amino)-N-(2-chlorophenyl)benzamide (1158838-41-5)

Guidance literature:

Multi-step reaction with 3 steps

1.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol / dichloromethane / 1 h / 20 °C

1.2: 24 h / 20 °C / Inert atmosphere

2.1: trifluoroacetic acid / dichloromethane / 1 h / 20 °C

3.1: dichloromethane / 12 h / 20 °C

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; trifluoroacetic acid; In dichloromethane;

DOI:10.1016/j.bmc.2018.11.006

Reference yield:

o-chloroaniline (95-51-2) → 4-((2-chloro-5-fluoropyrimidin-4-yl)amino)-N-(2-chlorophenyl)benzamide (1158838-41-5)

Guidance literature:

Multi-step reaction with 3 steps

1.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol / dichloromethane / 1 h / 20 °C

1.2: 24 h / 20 °C / Inert atmosphere

2.1: trifluoroacetic acid / dichloromethane / 1 h / 20 °C

3.1: dichloromethane / 12 h / 20 °C

With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; trifluoroacetic acid; In dichloromethane;

DOI:10.1016/j.bmc.2018.11.006

upstream raw materials:

4-amino-N-(2-chlorophenyl)benzamide

2,4-dichloro-5-fluoropyrimidine

4-(N-tert-butoxycarbonyl)aminobenzoic acid

o-chloroaniline

Downstream raw materials:

2-(4-(4-(4-(2-chlorophenylcarbamoyl)phenylamino)-5-fluoropyrimidin-2-ylamino)phenyl)acetic acid

N-(2-chlorophenyl)-4-(5-fluoro-2-(4-hydroxyphenylamino)pyrimidin-4-ylamino)benzamide

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