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Cas Database

100002-56-0

100002-56-0

Identification

  • Product Name:[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

  • CAS Number: 100002-56-0

  • EINECS:

  • Molecular Weight:515.653

  • Molecular Formula: C27H41N5O5

  • HS Code:

  • Mol File:100002-56-0.mol

Synonyms:

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Relevant articles and documentsAll total 1 Articles be found

Dipeptide Renin Inhibitors Containing a Bisacetyl Group as the N-Terminal Component

Nishi, Takahide,Morisawa, Yasuhiro,Iijima, Yasuteru,Koike, Hiroyuki,Yabe, Yuichiro

, p. 1672 - 1673 (2007/10/02)

The syntheses and biological activities of potent dipeptide renin inhibitors containing a bisacetyl group as the N-terminal component are described.

Process route upstream and downstream products

Process route

(3S,4S)-ethyl 4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoate
67010-43-9

(3S,4S)-ethyl 4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoate

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester
100002-56-0,104597-04-8

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

Conditions
Conditions Yield
Multi-step reaction with 4 steps
1: 4 M HCl/dioxane
2: 62 percent / azide method
3: 74 percent / N2H4 / H2O
4: 60 percent / azide method
With hydrogenchloride; hydrazine; In water;
H-(SS)-Sta-OEt
100002-32-2

H-(SS)-Sta-OEt

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester
100002-56-0,104597-04-8

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

Conditions
Conditions Yield
Multi-step reaction with 3 steps
1: 62 percent / azide method
2: 74 percent / N2H4 / H2O
3: 60 percent / azide method
With hydrazine; In water;
N-Cbz-His-Sta-OEt
132847-96-2

N-Cbz-His-Sta-OEt

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester
100002-56-0,104597-04-8

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

Conditions
Conditions Yield
Multi-step reaction with 2 steps
1: 74 percent / N2H4 / H2O
2: 60 percent / azide method
With hydrazine; In water;
(S)-2-methylbutylamine
34985-37-0

(S)-2-methylbutylamine

[(S)-1-[(S)-1-((S)-2-Hydrazinocarbonyl-1-hydroxy-ethyl)-3-methyl-butylcarbamoyl]-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

[(S)-1-[(S)-1-((S)-2-Hydrazinocarbonyl-1-hydroxy-ethyl)-3-methyl-butylcarbamoyl]-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester
100002-56-0,104597-04-8

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

Conditions
Conditions Yield
azide method;
60%
(3S,4S)-ethyl 4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoate
67010-43-9

(3S,4S)-ethyl 4-(tert-butoxycarbonylamino)-3-hydroxy-6-methylheptanoate

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester
100002-56-0,104597-04-8

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

Conditions
Conditions Yield
Multi-step reaction with 4 steps
1: 4 M HCl/dioxane
2: 62 percent / azide method
3: 74 percent / N2H4 / H2O
4: 60 percent / azide method
With hydrogenchloride; hydrazine; In water;
H-(SS)-Sta-OEt
100002-32-2

H-(SS)-Sta-OEt

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester
100002-56-0,104597-04-8

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

Conditions
Conditions Yield
Multi-step reaction with 3 steps
1: 62 percent / azide method
2: 74 percent / N2H4 / H2O
3: 60 percent / azide method
With hydrazine; In water;
N-Cbz-His-Sta-OEt
132847-96-2

N-Cbz-His-Sta-OEt

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester
100002-56-0,104597-04-8

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

Conditions
Conditions Yield
Multi-step reaction with 2 steps
1: 74 percent / N2H4 / H2O
2: 60 percent / azide method
With hydrazine; In water;
(S)-2-methylbutylamine
34985-37-0

(S)-2-methylbutylamine

[(S)-1-[(S)-1-((S)-2-Hydrazinocarbonyl-1-hydroxy-ethyl)-3-methyl-butylcarbamoyl]-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

[(S)-1-[(S)-1-((S)-2-Hydrazinocarbonyl-1-hydroxy-ethyl)-3-methyl-butylcarbamoyl]-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester
100002-56-0,104597-04-8

[(S)-1-{(S)-1-[(S)-1-Hydroxy-2-((S)-2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-carbamic acid benzyl ester

Conditions
Conditions Yield
azide method;
60%

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