C₂₈H₃₁N₇O₃*C₇H₈O₃S

Base Information

• Chemical Name: C₂₈H₃₁N₇O₃*C₇H₈O₃S
• CAS No.: 1610758-18-3
• Molecular Formula: C₇H₈O₃S*C₂₈H₃₁N₇O₃
• Molecular Weight: 685.804
• Mol file: 1610758-18-3.mol

Synonyms:C₂₈H₃₁N₇O₃*C₇H₈O₃S

Chemical Property of C₂₈H₃₁N₇O₃*C₇H₈O₃S

Chemical Property:

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

Technology Process of C₂₈H₃₁N₇O₃*C₇H₈O₃S

There total 2 articles about C₂₈H₃₁N₇O₃*C₇H₈O₃S 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: 73.7%

3-(2-(((4-cyanophenyl)amino)methyl)-1-methyl-N-(pyridin-2-yl)-1H-benzo[d]imidazole-5-carboxamido)propionic acid (212322-77-5) + toluene-4-sulfonic acid (104-15-4) + isopropyl alcohol (67-63-0,8013-70-5) → C28H31N7O3*C7H8O3S (1610758-18-3)

Guidance literature:

3-(2-(((4-cyanophenyl)amino)methyl)-1-methyl-N-(pyridin-2-yl)-1H-benzo[d]imidazole-5-carboxamido)propionic acid; toluene-4-sulfonic acid; isopropyl alcohol; With hydrogenchloride; at 20 ℃; for 8h;

With ammonium hydroxide; In water; at 0 - 20 ℃; for 5h;

DOI:10.1021/op500084q

Reference yield:

3-[[[2-[[(4-cyanophenyl)amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl](pyridin-2-yl)amino]propionic acid ethyl ester (211915-84-3) → C28H31N7O3*C7H8O3S (1610758-18-3)

Guidance literature:

Multi-step reaction with 2 steps

1.1: sodium hydroxide / water; ethanol / 2 h / 20 °C

2.1: hydrogenchloride / 8 h / 20 °C

2.2: 5 h / 0 - 20 °C

With hydrogenchloride; sodium hydroxide; In ethanol; water;

DOI:10.1021/op500084q

Reference yield: 71.6%

n-hexyl chloroformate (6092-54-2) + C28H31N7O3*C7H8O3S (1610758-18-3) → C35H43N7O5 (1610758-19-4)

Guidance literature:

With potassium carbonate; at 20 ℃; for 2h;

DOI:10.1021/op500084q

upstream raw materials:

3-(2-(((4-cyanophenyl)amino)methyl)-1-methyl-N-(pyridin-2-yl)-1H-benzo[d]imidazole-5-carboxamido)propionic acid

toluene-4-sulfonic acid

isopropyl alcohol

3-[[[2-[[(4-cyanophenyl)amino]methyl]-1-methyl-1H-benzimidazol-5-yl]carbonyl](pyridin-2-yl)amino]propionic acid ethyl ester

Downstream raw materials:

C₃₅H₄₃N₇O₅

Refernces