(2-{(S)-1-[2-((1S,2S)-3-{(1S,2S)-1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethylcarbamoyl}-1,1-dimethyl-ethyl)-carbamic acid tert-butyl ester

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Chemical Name:(2-{(S)-1-[2-((1S,2S)-3-{(1S,2S)-1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethylcarbamoyl}-1,1-dimethyl-ethyl)-carbamic acid tert-butyl ester
CAS No.:136630-98-3
Molecular Formula:C₄₅H₇₁N₉O₈
Molecular Weight:866.114
Hs Code.:

(2-{(S)-1-[2-((1S,2S)-3-{(1S,2S)-1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethylcarbamoyl}-1,1-dimethyl-ethyl)-carbamic acid tert-butyl ester

Synonyms:(2-{(S)-1-[2-((1S,2S)-3-{(1S,2S)-1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethylcarbamoyl}-1,1-dimethyl-ethyl)-carbamic acid tert-butyl ester

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Chemical Property of (2-{(S)-1-[2-((1S,2S)-3-{(1S,2S)-1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethylcarbamoyl}-1,1-dimethyl-ethyl)-carbamic acid tert-butyl ester

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Technology Process of (2-{(S)-1-[2-((1S,2S)-3-{(1S,2S)-1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethylcarbamoyl}-1,1-dimethyl-ethyl)-carbamic acid tert-butyl ester

There total 4 articles about (2-{(S)-1-[2-((1S,2S)-3-{(1S,2S)-1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethylcarbamoyl}-1,1-dimethyl-ethyl)-carbamic acid tert-butyl 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: 64.0%

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

: 136630-78-9
H-Phe-β-Ala-ACHPA-Ile N-<(4-amino-2-methyl-5-pyrimidinyl)methyl>amide dihydrochloride

: 136630-98-3
(2-{(S)-1-[2-((1S,2S)-3-{(1S,2S)-1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethylcarbamoyl}-1,1-dimethyl-ethyl)-carbamic acid tert-butyl ester

Guidance literature:: With 4-methyl-morpholine; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In N,N-dimethyl-formamide; for 14h; Ambient temperature;
DOI:10.1021/jm00115a016

Reference yield:

: 118700-84-8
(S)-3-(2-(tert-butoxycarbonylamino)-3-phenyl-propanamido)propanoic acid

: 136630-98-3
(2-{(S)-1-[2-((1S,2S)-3-{(1S,2S)-1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethylcarbamoyl}-1,1-dimethyl-ethyl)-carbamic acid tert-butyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: 76 percent / N-NMM, 1-hydroxybenzotriazole (HOBT), N-ethyl-N'-<3-(dimethylamino)propyl>carbodiimide hydrochloride (EDCI) / dimethylformamide / 14 h / Ambient temperature

2: 4N aq. HCl / dioxane / 1 h / Ambient temperature

3: 64 percent / N-methylmorpholine (NMM), 1-hydroxybenzotriazole (HOBT), N-ethyl-N'-<3-(dimethylamino)propyl>carbodiimide hydrochloride (EDCI) / dimethylformamide / 14 h / Ambient temperature

With 4-methyl-morpholine; hydrogenchloride; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In 1,4-dioxane; N,N-dimethyl-formamide;
DOI:10.1021/jm00115a016

Reference yield:

: 136735-33-6
H-ACHPA-Ile N-<(4-amino-2-methyl-5-pyrimidinyl)methyl>amide dihydrochloride

: 136630-98-3
(2-{(S)-1-[2-((1S,2S)-3-{(1S,2S)-1-[(4-Amino-2-methyl-pyrimidin-5-ylmethyl)-carbamoyl]-2-methyl-butylcarbamoyl}-1-cyclohexylmethyl-2-hydroxy-propylcarbamoyl)-ethylcarbamoyl]-2-phenyl-ethylcarbamoyl}-1,1-dimethyl-ethyl)-carbamic acid tert-butyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: 76 percent / N-NMM, 1-hydroxybenzotriazole (HOBT), N-ethyl-N'-<3-(dimethylamino)propyl>carbodiimide hydrochloride (EDCI) / dimethylformamide / 14 h / Ambient temperature

2: 4N aq. HCl / dioxane / 1 h / Ambient temperature

3: 64 percent / N-methylmorpholine (NMM), 1-hydroxybenzotriazole (HOBT), N-ethyl-N'-<3-(dimethylamino)propyl>carbodiimide hydrochloride (EDCI) / dimethylformamide / 14 h / Ambient temperature

With 4-methyl-morpholine; hydrogenchloride; benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In 1,4-dioxane; N,N-dimethyl-formamide;
DOI:10.1021/jm00115a016