tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-3-{[(2H₃)methoxy]imino}-7-oxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate

Base Information

• Chemical Name: tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-3-{[(2H₃)methoxy]imino}-7-oxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate
• CAS No.: 1312771-07-5
• Molecular Formula: C₄₀H₅₀ClN₅O₁₁
• Molecular Weight: 815.293

Synonyms:tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-3-{[(2H₃)methoxy]imino}-7-oxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate

Chemical Property of tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-3-{[(2H₃)methoxy]imino}-7-oxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate

Chemical Property:

Purity/Quality:

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Technology Process of tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-3-{[(2H₃)methoxy]imino}-7-oxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate

There total 4 articles about tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-3-{[(2H₃)methoxy]imino}-7-oxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate 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:

iodomethane-d3 (865-50-9) + tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-3-(hydroxyimino)-7-oxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate (1312771-06-4) → tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-3-{[(2H3)methoxy]imino}-7-oxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate (1312771-07-5)

Guidance literature:

iodomethane-d3; tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-3-(hydroxyimino)-7-oxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate; With sodium hydride; In N,N-dimethyl-formamide; mineral oil; at 20 ℃; for 0.75h;

With water; ammonium chloride; In hexane; ethyl acetate; N,N-dimethyl-formamide; mineral oil;

Reference yield:

tert-butyl 4-[(1R)-1-isocyanatobutyl]-2-nitrobenzoate (1312770-12-9) → tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-3-{[(2H3)methoxy]imino}-7-oxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate (1312771-07-5)

Guidance literature:

Multi-step reaction with 4 steps

1: potassium tert-butylate / acetonitrile; tetrahydrofuran / 1 h / Cooling with ice

2: 2,4-(4-phenoxyphenyl)-1,3-dithia-2λ(5),4λ(5)-diphosphetane 2,4-disulfides / tetrahydrofuran / 2 h / Cooling with ice

3: hydroxylamine hydrochloride; triethylamine; mercury(II) diacetate / tetrahydrofuran; methanol / 3 h / 0 °C

4: sodium hydride / N,N-dimethyl-formamide; mineral oil / 0.75 h / 20 °C

With hydroxylamine hydrochloride; potassium tert-butylate; mercury(II) diacetate; sodium hydride; 2,4-(4-phenoxyphenyl)-1,3-dithia-2λ(5),4λ(5)-diphosphetane 2,4-disulfides; triethylamine; In tetrahydrofuran; methanol; N,N-dimethyl-formamide; acetonitrile; mineral oil;

Reference yield:

tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-7-oxo-3-thioxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate (1312770-25-4) → tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-3-{[(2H3)methoxy]imino}-7-oxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate (1312771-07-5)

Guidance literature:

Multi-step reaction with 2 steps

1: hydroxylamine hydrochloride; triethylamine; mercury(II) diacetate / tetrahydrofuran; methanol / 3 h / 0 °C

2: sodium hydride / N,N-dimethyl-formamide; mineral oil / 0.75 h / 20 °C

With hydroxylamine hydrochloride; mercury(II) diacetate; sodium hydride; triethylamine; In tetrahydrofuran; methanol; N,N-dimethyl-formamide; mineral oil;

upstream raw materials:

iodomethane-d3

tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-3-(hydroxyimino)-7-oxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate

tert-butyl 4-[(1R)-1-isocyanatobutyl]-2-nitrobenzoate

tert-butyl 4-[(1R)-1-({[(6S)-6-(5-chloro-2-methoxybenzyl)-7-oxo-3-thioxo-4-(2,4,6-trimethoxybenzyl)-1,4-diazepan-1-yl]carbonyl}amino)butyl]-2-nitrobenzoate

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