2-(3-fluoro-phenyl)-4-methylpyrimidine-5-carboxylic acid (3-cyano-5-fluoro-indol-1-yl)-amide

Base Information

• Chemical Name: 2-(3-fluoro-phenyl)-4-methylpyrimidine-5-carboxylic acid (3-cyano-5-fluoro-indol-1-yl)-amide
• CAS No.: 1068968-60-4
• Molecular Formula: C₂₁H₁₃F₂N₅O
• Molecular Weight: 389.364
• Mol file: 1068968-60-4.mol

Synonyms:2-(3-fluoro-phenyl)-4-methylpyrimidine-5-carboxylic acid (3-cyano-5-fluoro-indol-1-yl)-amide

Chemical Property of 2-(3-fluoro-phenyl)-4-methylpyrimidine-5-carboxylic acid (3-cyano-5-fluoro-indol-1-yl)-amide

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 2-(3-fluoro-phenyl)-4-methylpyrimidine-5-carboxylic acid (3-cyano-5-fluoro-indol-1-yl)-amide

There total 5 articles about 2-(3-fluoro-phenyl)-4-methylpyrimidine-5-carboxylic acid (3-cyano-5-fluoro-indol-1-yl)-amide 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: 38.0%

isocyanate de chlorosulfonyle (1189-71-5) + 2-(3-fluorophenyl)-4-methylpyrimidine-5-carboxylic acid (5-fluoroindol-1-yl)amide (1068970-28-4) → 2-(3-fluoro-phenyl)-4-methylpyrimidine-5-carboxylic acid (3-cyano-5-fluoro-indol-1-yl)-amide (1068968-60-4)

Guidance literature:

isocyanate de chlorosulfonyle; 2-(3-fluorophenyl)-4-methylpyrimidine-5-carboxylic acid (5-fluoroindol-1-yl)amide; In tetrahydrofuran; at 0 - 20 ℃; for 1h;

With triethylamine; In tetrahydrofuran; for 1h;

Reference yield:

2-(3-fluoro-phenyl)-4-methyl-pyrimidine-5-carboxylic acid ethyl ester → 2-(3-fluoro-phenyl)-4-methylpyrimidine-5-carboxylic acid (3-cyano-5-fluoro-indol-1-yl)-amide (1068968-60-4)

Guidance literature:

Multi-step reaction with 3 steps

1.1: methanol; sodium hydroxide; water / tetrahydrofuran / 0.75 h / Heating / reflux

1.2: pH 2 - 3

2.1: N,N-diethyl-N-isopropylamine; O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate / N,N-dimethyl-formamide / 8 h / 20 - 80 °C

3.1: tetrahydrofuran / 1 h / 0 - 20 °C

3.2: 1 h

With methanol; sodium hydroxide; N,N-diethyl-N-isopropylamine; water; O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; In tetrahydrofuran; N,N-dimethyl-formamide;

Reference yield:

2-(3-fluoro-phenyl)-4-methyl-pyrimidine-5-carboxylic acid (933989-07-2) → 2-(3-fluoro-phenyl)-4-methylpyrimidine-5-carboxylic acid (3-cyano-5-fluoro-indol-1-yl)-amide (1068968-60-4)

Guidance literature:

Multi-step reaction with 2 steps

1.1: N,N-diethyl-N-isopropylamine; O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate / N,N-dimethyl-formamide / 8 h / 20 - 80 °C

2.1: tetrahydrofuran / 1 h / 0 - 20 °C

2.2: 1 h

With N,N-diethyl-N-isopropylamine; O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; In tetrahydrofuran; N,N-dimethyl-formamide;

upstream raw materials:

isocyanate de chlorosulfonyle

2-(3-fluorophenyl)-4-methylpyrimidine-5-carboxylic acid (5-fluoroindol-1-yl)amide

5-fluoro-1H-indole

2-(3-fluoro-phenyl)-4-methyl-pyrimidine-5-carboxylic acid

Downstream raw materials:

2-(3-fluoro-phenyl)-4-methylpyrimidine-5-carboxylic acid [5-fluoro-3-(1H-tetrazol-5-yl)-indol-1-yl]-amide