(2S,4S,5S)-5-[(S)-2-{[(S)-2-(3-Amino-3-methyl-butyrylamino)-3-phenyl-propionyl]-methyl-amino}-3-(1H-imidazol-4-yl)-propionylamino]-6-cyclohexyl-4-hydroxy-2-isopropyl-hexanoic acid ((S)-2-methyl-butyl)-amide

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Chemical Name:(2S,4S,5S)-5-[(S)-2-{[(S)-2-(3-Amino-3-methyl-butyrylamino)-3-phenyl-propionyl]-methyl-amino}-3-(1H-imidazol-4-yl)-propionylamino]-6-cyclohexyl-4-hydroxy-2-isopropyl-hexanoic acid ((S)-2-methyl-butyl)-amide
CAS No.:135378-56-2
Molecular Formula:C₄₁H₆₇N₇O₅
Molecular Weight:738.027
Hs Code.:

(2S,4S,5S)-5-[(S)-2-{[(S)-2-(3-Amino-3-methyl-butyrylamino)-3-phenyl-propionyl]-methyl-amino}-3-(1H-imidazol-4-yl)-propionylamino]-6-cyclohexyl-4-hydroxy-2-isopropyl-hexanoic acid ((S)-2-methyl-butyl)-amide

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Chemical Property of (2S,4S,5S)-5-[(S)-2-{[(S)-2-(3-Amino-3-methyl-butyrylamino)-3-phenyl-propionyl]-methyl-amino}-3-(1H-imidazol-4-yl)-propionylamino]-6-cyclohexyl-4-hydroxy-2-isopropyl-hexanoic acid ((S)-2-methyl-butyl)-amide

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Technology Process of (2S,4S,5S)-5-[(S)-2-{[(S)-2-(3-Amino-3-methyl-butyrylamino)-3-phenyl-propionyl]-methyl-amino}-3-(1H-imidazol-4-yl)-propionylamino]-6-cyclohexyl-4-hydroxy-2-isopropyl-hexanoic acid ((S)-2-methyl-butyl)-amide

There total 6 articles about (2S,4S,5S)-5-[(S)-2-{[(S)-2-(3-Amino-3-methyl-butyrylamino)-3-phenyl-propionyl]-methyl-amino}-3-(1H-imidazol-4-yl)-propionylamino]-6-cyclohexyl-4-hydroxy-2-isopropyl-hexanoic acid ((S)-2-methyl-butyl)-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:

: 135378-87-9
[2-((S)-1-{[(S)-1-[(1S,2S,4S)-1-Cyclohexylmethyl-2-hydroxy-5-methyl-4-((S)-2-methyl-butylcarbamoyl)-hexylcarbamoyl]-2-(1H-imidazol-4-yl)-ethyl]-methyl-carbamoyl}-2-phenyl-ethylcarbamoyl)-1,1-dimethyl-ethyl]-carbamic acid tert-butyl ester

: 135378-56-2
(2S,4S,5S)-5-[(S)-2-{[(S)-2-(3-Amino-3-methyl-butyrylamino)-3-phenyl-propionyl]-methyl-amino}-3-(1H-imidazol-4-yl)-propionylamino]-6-cyclohexyl-4-hydroxy-2-isopropyl-hexanoic acid ((S)-2-methyl-butyl)-amide

Guidance literature:: With trifluoroacetic acid; In dichloromethane; for 1h;
DOI:10.1021/jm00106a026

Reference yield:

: 638-10-8
ethyl 3-methylbut-2-enoate

: 135378-56-2
(2S,4S,5S)-5-[(S)-2-{[(S)-2-(3-Amino-3-methyl-butyrylamino)-3-phenyl-propionyl]-methyl-amino}-3-(1H-imidazol-4-yl)-propionylamino]-6-cyclohexyl-4-hydroxy-2-isopropyl-hexanoic acid ((S)-2-methyl-butyl)-amide

Guidance literature:: Multi-step reaction with 6 steps

1: 89 percent / NH₃(gas) / ethanol / 22 h / 80 °C

2: 81 percent / CH₂Cl₂ / 18 h

3: 82 percent / aq. KOH / tetrahydrofuran / 18 h

4: diisopropylethylamine, diethylphosphorocyanate / CH₂Cl₂ / 18 h

5: 1-hydroxybenzotriazole / methanol / 18 h

6: trifluoroacetic acid / CH₂Cl₂ / 1 h

With potassium hydroxide; diethyl cyanophosphonate; ammonia; benzotriazol-1-ol; N-ethyl-N,N-diisopropylamine; trifluoroacetic acid; In tetrahydrofuran; methanol; ethanol; dichloromethane;
DOI:10.1021/jm00106a026

Reference yield:

: 129765-95-3
3-[(tert-butoxycarbonyl)amino]-3-methylbutanoic acid

: 135378-56-2
(2S,4S,5S)-5-[(S)-2-{[(S)-2-(3-Amino-3-methyl-butyrylamino)-3-phenyl-propionyl]-methyl-amino}-3-(1H-imidazol-4-yl)-propionylamino]-6-cyclohexyl-4-hydroxy-2-isopropyl-hexanoic acid ((S)-2-methyl-butyl)-amide

Guidance literature:: Multi-step reaction with 3 steps

1: diisopropylethylamine, diethylphosphorocyanate / CH₂Cl₂ / 18 h

2: 1-hydroxybenzotriazole / methanol / 18 h

3: trifluoroacetic acid / CH₂Cl₂ / 1 h

With diethyl cyanophosphonate; benzotriazol-1-ol; N-ethyl-N,N-diisopropylamine; trifluoroacetic acid; In methanol; dichloromethane;
DOI:10.1021/jm00106a026