N-(5-((4-(1-cyclopropyl-1H-benzazole-3-yl)pyrimidine-2-yl)amino)-2-((2-(dimethylamino)ethyl)(methyl)amino)-4-methoxyphenyl)propenamide

Base Information

• Chemical Name: N-(5-((4-(1-cyclopropyl-1H-benzazole-3-yl)pyrimidine-2-yl)amino)-2-((2-(dimethylamino)ethyl)(methyl)amino)-4-methoxyphenyl)propenamide
• CAS No.: 1899921-05-1
• Molecular Formula: C₃₀H₃₅N₇O₂
• Molecular Weight: 525.654
• Mol file: 1899921-05-1.mol

Synonyms:

Chemical Property of N-(5-((4-(1-cyclopropyl-1H-benzazole-3-yl)pyrimidine-2-yl)amino)-2-((2-(dimethylamino)ethyl)(methyl)amino)-4-methoxyphenyl)propenamide

Chemical Property:

• Density: 1.24±0.1 g/cm3(Predicted)

Purity/Quality:

99% ^*data from raw suppliers

HS-10296 >98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of N-(5-((4-(1-cyclopropyl-1H-benzazole-3-yl)pyrimidine-2-yl)amino)-2-((2-(dimethylamino)ethyl)(methyl)amino)-4-methoxyphenyl)propenamide

There total 9 articles about N-(5-((4-(1-cyclopropyl-1H-benzazole-3-yl)pyrimidine-2-yl)amino)-2-((2-(dimethylamino)ethyl)(methyl)amino)-4-methoxyphenyl)propenamide 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: 88.8%

N4-(4-(1-cyclopropyl-1H-indole-3-yl)pyrimidin-2-yl)-N1-(2-(dimethylamino)ethyl)-5-methoxy-N1-methylbenzene-1,2,4-triamine + 2-chloropropionyl chloride (625-36-5) → N-(5-((4-(1-cyclopropyl-1H-benzazole-3-yl)pyrimidine-2-yl)amino)-2-((2-(dimethylamino)ethyl)(methyl)amino)-4-methoxyphenyl)propenamide (1899921-05-1)

Guidance literature:

N₄-(4-(1-cyclopropyl-1H-indole-3-yl)pyrimidin-2-yl)-N₁-(2-(dimethylamino)ethyl)-5-methoxy-N₁-methylbenzene-1,2,4-triamine; 2-chloropropionyl chloride; In tetrahydrofuran; n-heptane; at 0 - 25 ℃; for 0.5h; Inert atmosphere;

With potassium hydroxide; In tetrahydrofuran; water; at 70 ℃; for 25h;

Reference yield: 85.0%

N4-(4-(1-cyclopropyl-1H-indole-3-yl)pyrimidin-2-yl)-N1-(2-(dimethylamino)ethyl)-5-methoxy-N1-methylbenzene-1,2,4-triamine + acryloyl chloride (814-68-6,25189-84-8) → N-(5-((4-(1-cyclopropyl-1H-benzazole-3-yl)pyrimidine-2-yl)amino)-2-((2-(dimethylamino)ethyl)(methyl)amino)-4-methoxyphenyl)propenamide (1899921-05-1)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; at 0 ℃; for 5h;

DOI:10.1016/j.bmc.2021.116094

Reference yield:

4-(1-cyclopropyl-1H-indole-3-yl)-N-(4-fluoro-2-methoxy-5-nitrophenyl)pyrimidin-2-amine → N-(5-((4-(1-cyclopropyl-1H-benzazole-3-yl)pyrimidine-2-yl)amino)-2-((2-(dimethylamino)ethyl)(methyl)amino)-4-methoxyphenyl)propenamide (1899921-05-1)

Guidance literature:

Multi-step reaction with 3 steps

1.1: N-ethyl-N,N-diisopropylamine / N,N-dimethyl acetamide; water / 23 h / 5 - 85 °C / Inert atmosphere

2.1: hydrogen / tetrahydrofuran; ethanol / 24 h

3.1: tetrahydrofuran; n-heptane / 0.5 h / 0 - 25 °C / Inert atmosphere

3.2: 25 h / 70 °C

With hydrogen; N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; ethanol; n-heptane; N,N-dimethyl acetamide; water;

upstream raw materials:

2-chloropropionyl chloride

3-(2-chloro-pyrimidin-4-yl)-1H-indole

indole

acryloyl chloride

Downstream raw materials:

C₃₀H₃₅N₇O₂*(x)ClH