(3S,4aS,8aS)-N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-{[N-(methylsulfonyl)-3-(naphthalen-2-ylsulfinyl)-D-alanyl]amino}-4-phenylbutyl]decahydroisoquinoline-3-carboxamide

Base Information

Chemical Name:(3S,4aS,8aS)-N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-{[N-(methylsulfonyl)-3-(naphthalen-2-ylsulfinyl)-D-alanyl]amino}-4-phenylbutyl]decahydroisoquinoline-3-carboxamide
CAS No.:159878-30-5
Molecular Formula:C₃₈H₅₂N₄O₆S₂
Molecular Weight:724.986
Hs Code.:
Mol file:159878-30-5.mol

(3S,4aS,8aS)-N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-{[N-(methylsulfonyl)-3-(naphthalen-2-ylsulfinyl)-D-alanyl]amino}-4-phenylbutyl]decahydroisoquinoline-3-carboxamide

Synonyms:

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of (3S,4aS,8aS)-N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-{[N-(methylsulfonyl)-3-(naphthalen-2-ylsulfinyl)-D-alanyl]amino}-4-phenylbutyl]decahydroisoquinoline-3-carboxamide

Chemical Property:

Density:1.3g/cm³

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Technology Process of (3S,4aS,8aS)-N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-{[N-(methylsulfonyl)-3-(naphthalen-2-ylsulfinyl)-D-alanyl]amino}-4-phenylbutyl]decahydroisoquinoline-3-carboxamide

There total 7 articles about (3S,4aS,8aS)-N-tert-butyl-2-[(2R,3S)-2-hydroxy-3-{[N-(methylsulfonyl)-3-(naphthalen-2-ylsulfinyl)-D-alanyl]amino}-4-phenylbutyl]decahydroisoquinoline-3-carboxamide 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:

: 159878-29-2
(3S,4aS,8aS)-2-{(2R,3S)-2-Hydroxy-3-[(S)-2-methanesulfonylamino-3-(naphthalen-2-ylsulfanyl)-propionylamino]-4-phenyl-butyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide

: 159878-30-5
(3S,4aS,8aS)-2-{(2R,3S)-2-Hydroxy-3-[(S)-2-methanesulfonylamino-3-(naphthalene-2-sulfinyl)-propionylamino]-4-phenyl-butyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide

Guidance literature:: With sodium periodate; In methanol; at 20 ℃;
DOI:10.1021/jm020537i

Reference yield:

: 128018-44-0
N-benzyloxycarbonyl-3(S)-amino-1,2(S)epoxy-4-phenylbutane

: 159878-30-5
(3S,4aS,8aS)-2-{(2R,3S)-2-Hydroxy-3-[(S)-2-methanesulfonylamino-3-(naphthalene-2-sulfinyl)-propionylamino]-4-phenyl-butyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide

Guidance literature:: Multi-step reaction with 6 steps

1.1: 60.3 percent / propan-2-ol / 5 h / Heating

2.1: m-cresol; thioanisole; 1,2-ethanedithiol / TFA; TMSBr / 2 h / 0 °C

3.1: HOBt; BOP; DIPEA / dimethylformamide / 0.17 h / 0 °C

3.2: Et₃N / dimethylformamide / 0 - 20 °C

4.1: HCl / dioxane / 0 - 20 °C

5.1: DIPEA / dimethylformamide / 0 - 20 °C

6.1: aq. NaIO₄ / methanol / 20 °C

With hydrogenchloride; sodium periodate; methyl-phenyl-thioether; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; benzotriazol-1-ol; ethane-1,2-dithiol; 3-methyl-phenol; N-ethyl-N,N-diisopropylamine; trimethylsilyl bromide; trifluoroacetic acid; In 1,4-dioxane; methanol; N,N-dimethyl-formamide; isopropyl alcohol;
DOI:10.1021/jm020537i

Reference yield:

: 128019-40-9,149510-73-6,136465-81-1,168899-60-3
(3S,4aS,8aS)-N-tert-butyl-decahydroisoquinoline-3-carboxamide

: 159878-30-5
(3S,4aS,8aS)-2-{(2R,3S)-2-Hydroxy-3-[(S)-2-methanesulfonylamino-3-(naphthalene-2-sulfinyl)-propionylamino]-4-phenyl-butyl}-decahydro-isoquinoline-3-carboxylic acid tert-butylamide

Guidance literature:: Multi-step reaction with 6 steps

1.1: 60.3 percent / propan-2-ol / 5 h / Heating

2.1: m-cresol; thioanisole; 1,2-ethanedithiol / TFA; TMSBr / 2 h / 0 °C

3.1: HOBt; BOP; DIPEA / dimethylformamide / 0.17 h / 0 °C

3.2: Et₃N / dimethylformamide / 0 - 20 °C

4.1: HCl / dioxane / 0 - 20 °C

5.1: DIPEA / dimethylformamide / 0 - 20 °C

6.1: aq. NaIO₄ / methanol / 20 °C

With hydrogenchloride; sodium periodate; methyl-phenyl-thioether; (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; benzotriazol-1-ol; ethane-1,2-dithiol; 3-methyl-phenol; N-ethyl-N,N-diisopropylamine; trimethylsilyl bromide; trifluoroacetic acid; In 1,4-dioxane; methanol; N,N-dimethyl-formamide; isopropyl alcohol;
DOI:10.1021/jm020537i