4-((4-(3-(dibutylcarbamoyl)-5-methyl-1H-pyrazol-1-yl)-3-((S)-3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)phenyl)amino)-4-oxo-3-phenylbutanoic acid

Base Information

Chemical Name:4-((4-(3-(dibutylcarbamoyl)-5-methyl-1H-pyrazol-1-yl)-3-((S)-3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)phenyl)amino)-4-oxo-3-phenylbutanoic acid
CAS No.:1445828-51-2
Molecular Formula:C₄₀H₄₇N₅O₆
Molecular Weight:693.843
Hs Code.:

4-((4-(3-(dibutylcarbamoyl)-5-methyl-1H-pyrazol-1-yl)-3-((S)-3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)phenyl)amino)-4-oxo-3-phenylbutanoic acid

Synonyms:4-((4-(3-(dibutylcarbamoyl)-5-methyl-1H-pyrazol-1-yl)-3-((S)-3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)phenyl)amino)-4-oxo-3-phenylbutanoic acid

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Chemical Property of 4-((4-(3-(dibutylcarbamoyl)-5-methyl-1H-pyrazol-1-yl)-3-((S)-3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)phenyl)amino)-4-oxo-3-phenylbutanoic acid

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Technology Process of 4-((4-(3-(dibutylcarbamoyl)-5-methyl-1H-pyrazol-1-yl)-3-((S)-3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)phenyl)amino)-4-oxo-3-phenylbutanoic acid

There total 10 articles about 4-((4-(3-(dibutylcarbamoyl)-5-methyl-1H-pyrazol-1-yl)-3-((S)-3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)phenyl)amino)-4-oxo-3-phenylbutanoic acid 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: 53.0%

: 1445828-55-6
methyl 4-((4-(3-(dibutylcarbamoyl)-5-methyl-1H-pyrazol-1-yl)-3-((S)-3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)phenyl)amino)-4-oxo-3-phenylbutanoate

: 1445828-51-2
4-((4-(3-(dibutylcarbamoyl)-5-methyl-1H-pyrazol-1-yl)-3-((S)-3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)phenyl)amino)-4-oxo-3-phenylbutanoic acid

Guidance literature:: With lithium hydroxide monohydrate; In tetrahydrofuran; water; at 20 ℃; for 5h;

Reference yield:

: 1445778-85-7
(S)-ethyl 1-(2-(3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)-4-nitrophenyl)-5-methyl-1H-pyrazole-3-carboxylate

: 1445828-51-2
4-((4-(3-(dibutylcarbamoyl)-5-methyl-1H-pyrazol-1-yl)-3-((S)-3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)phenyl)amino)-4-oxo-3-phenylbutanoic acid

Guidance literature:: Multi-step reaction with 6 steps

1: lithium hydroxide monohydrate / water; tetrahydrofuran / 6 h / 20 °C

2: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol / N,N-dimethyl-formamide / 12 h / 20 °C

3: 1H-imidazole / dichloromethane / 12 h / 20 °C

4: palladium 10% on activated carbon; hydrogen / ethanol / 3 h / 20 °C

5: triethylamine / dichloromethane / 1 h / 20 °C

6: lithium hydroxide monohydrate / water; tetrahydrofuran / 5 h / 20 °C

With 1H-imidazole; lithium hydroxide monohydrate; palladium 10% on activated carbon; hydrogen; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; In tetrahydrofuran; ethanol; dichloromethane; water; N,N-dimethyl-formamide;

Reference yield:

: 616-79-5
2-amino-5-nitro-benzoic acid

: 1445828-51-2
4-((4-(3-(dibutylcarbamoyl)-5-methyl-1H-pyrazol-1-yl)-3-((S)-3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-2-carbonyl)phenyl)amino)-4-oxo-3-phenylbutanoic acid

Guidance literature:: Multi-step reaction with 9 steps

1.1: hydrogenchloride; sodium nitrite / water / 0.25 h / 0 °C

1.2: 12 h / 0 - 20 °C

2.1: acetic acid / 2 h / Reflux

3.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol / N,N-dimethyl-formamide / 12 h / 20 °C / Cooling with ice

4.1: lithium hydroxide monohydrate / water; tetrahydrofuran / 6 h / 20 °C

5.1: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; benzotriazol-1-ol / N,N-dimethyl-formamide / 12 h / 20 °C

6.1: 1H-imidazole / dichloromethane / 12 h / 20 °C

7.1: palladium 10% on activated carbon; hydrogen / ethanol / 3 h / 20 °C

8.1: triethylamine / dichloromethane / 1 h / 20 °C

9.1: lithium hydroxide monohydrate / water; tetrahydrofuran / 5 h / 20 °C

With 1H-imidazole; hydrogenchloride; lithium hydroxide monohydrate; palladium 10% on activated carbon; hydrogen; benzotriazol-1-ol; acetic acid; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; sodium nitrite; In tetrahydrofuran; ethanol; dichloromethane; water; N,N-dimethyl-formamide;