3-[{2-[(4-carbamimidoylphenylamino)methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}(3-methylphenyl)amino]propionic acid ethyl ester

Base Information

Chemical Name:3-[{2-[(4-carbamimidoylphenylamino)methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}(3-methylphenyl)amino]propionic acid ethyl ester
CAS No.:763910-33-4
Molecular Formula:C₂₉H₃₂N₆O₃
Molecular Weight:512.611
Hs Code.:

Synonyms:3-[{2-[(4-carbamimidoylphenylamino)methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}(3-methylphenyl)amino]propionic acid ethyl ester

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Chemical Property of 3-[{2-[(4-carbamimidoylphenylamino)methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}(3-methylphenyl)amino]propionic acid ethyl ester

Chemical Property:

Purity/Quality:: 98% ^*data from raw suppliers

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Technology Process of 3-[{2-[(4-carbamimidoylphenylamino)methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}(3-methylphenyl)amino]propionic acid ethyl ester

There total 9 articles about 3-[{2-[(4-carbamimidoylphenylamino)methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}(3-methylphenyl)amino]propionic acid ethyl ester 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: 78.3%

: 211916-51-7
3-({2-[(4-cyanophenylamino)methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}(3-methylphenyl)amino)propionic acid ethyl ester

: 763910-33-4
3-[{2-[(4-carbamimidoylphenylamino)methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}(3-methylphenyl)amino]propionic acid ethyl ester

Guidance literature:: 3-({2-[(4-cyanophenylamino)methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}(3-methylphenyl)amino)propionic acid ethyl ester; With hydroxylamine hydrochloride; triethylamine; In ethanol; at 80 ℃; for 3h;

With palladium 10% on activated carbon; ammonium formate; acetic acid; at 120 ℃; for 5h; Inert atmosphere;
DOI:10.1016/j.tet.2020.131027

Reference yield:

: C₂₀H₂₃N₃O₅

: 763910-33-4
3-[{2-[(4-carbamimidoylphenylamino)methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}(3-methylphenyl)amino]propionic acid ethyl ester

Guidance literature:: Multi-step reaction with 3 steps

1.1: zinc; acetic acid / water / 1 h / 20 °C

2.1: benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / tetrahydrofuran; N,N-dimethyl-formamide / 0.5 h / Cooling with ice

2.2: 5 h / 20 °C

2.3: 2.5 h / 120 °C

3.1: triethylamine; hydroxylamine hydrochloride / ethanol / 3 h / 80 °C

3.2: 5 h / 120 °C / Inert atmosphere

With hydroxylamine hydrochloride; benzotriazol-1-ol; acetic acid; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; zinc; In tetrahydrofuran; ethanol; water; N,N-dimethyl-formamide;
DOI:10.1016/j.tet.2020.131027

Reference yield:

: 3-[(3-amino-4-methylaminobenzoyl)m-tolylamino]propionic acid ethyl ester

: 763910-33-4
3-[{2-[(4-carbamimidoylphenylamino)methyl]-1-methyl-1H-benzoimidazole-5-carbonyl}(3-methylphenyl)amino]propionic acid ethyl ester

Guidance literature:: Multi-step reaction with 2 steps

1.1: benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / tetrahydrofuran; N,N-dimethyl-formamide / 0.5 h / Cooling with ice

1.2: 5 h / 20 °C

1.3: 2.5 h / 120 °C

2.1: triethylamine; hydroxylamine hydrochloride / ethanol / 3 h / 80 °C

2.2: 5 h / 120 °C / Inert atmosphere

With hydroxylamine hydrochloride; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; In tetrahydrofuran; ethanol; N,N-dimethyl-formamide;
DOI:10.1016/j.tet.2020.131027