3-[(4R,5S,6S,7R)-4,7-Dibenzyl-3-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-2-oxo-[1,3]diazepan-1-ylmethyl]-benzonitrile

Base Information

• Chemical Name: 3-[(4R,5S,6S,7R)-4,7-Dibenzyl-3-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-2-oxo-[1,3]diazepan-1-ylmethyl]-benzonitrile
• CAS No.: 1053611-65-6
• Molecular Formula: C₃₉H₅₁N₃O₇
• Molecular Weight: 673.85

Synonyms:3-[(4R,5S,6S,7R)-4,7-Dibenzyl-3-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-2-oxo-[1,3]diazepan-1-ylmethyl]-benzonitrile

Chemical Property of 3-[(4R,5S,6S,7R)-4,7-Dibenzyl-3-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-2-oxo-[1,3]diazepan-1-ylmethyl]-benzonitrile

Chemical Property:

Purity/Quality:

Safty Information:

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MSDS Files:

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Technology Process of 3-[(4R,5S,6S,7R)-4,7-Dibenzyl-3-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-2-oxo-[1,3]diazepan-1-ylmethyl]-benzonitrile

There total 2 articles about 3-[(4R,5S,6S,7R)-4,7-Dibenzyl-3-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-2-oxo-[1,3]diazepan-1-ylmethyl]-benzonitrile 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:

(4R,5S,6S,7R)-hexahydro-5,6-bis(2-methoxyethoxymethoxy)-4,7-bis(phenylmethyl)-2H-1,3-diazepin-2-one (153181-25-0) → 3-[(4R,5S,6S,7R)-4,7-Dibenzyl-3-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-2-oxo-[1,3]diazepan-1-ylmethyl]-benzonitrile (1053611-65-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 1.) KOH / 1.) toluene, reflux, 2.) toluene, 60 deg C, 18 h

2: 1.) NaH / 1.) DMF, 15 min, 2.) DMF, RT, 18 h

With potassium hydroxide; sodium hydride;

DOI:10.1021/jm960586t

Reference yield:

m-(bromomethyl)benzonitrile (28188-41-2) + (4R,5S,6S,7R)-4,7-Dibenzyl-1-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-[1,3]diazepan-2-one (1053710-77-2) → 3-[(4R,5S,6S,7R)-4,7-Dibenzyl-3-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-2-oxo-[1,3]diazepan-1-ylmethyl]-benzonitrile (1053611-65-6)

Guidance literature:

With sodium hydride; Multistep reaction; 1.) DMF, 15 min, 2.) DMF, RT, 18 h;

DOI:10.1021/jm960586t

Reference yield:

3-[(4R,5S,6S,7R)-4,7-Dibenzyl-3-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-2-oxo-[1,3]diazepan-1-ylmethyl]-benzonitrile (1053611-65-6) → 3-[(4R,5S,6S,7R)-4,7-Dibenzyl-3-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-2-oxo-[1,3]diazepan-1-ylmethyl]-benzoic acid (1054608-82-0)

Guidance literature:

With potassium hydroxide; In ethylene glycol; at 140 ℃; for 18h;

DOI:10.1021/jm960586t

upstream raw materials:

m-(bromomethyl)benzonitrile

(4R,5S,6S,7R)-4,7-Dibenzyl-1-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-[1,3]diazepan-2-one

(4R,5S,6S,7R)-hexahydro-5,6-bis(2-methoxyethoxymethoxy)-4,7-bis(phenylmethyl)-2H-1,3-diazepin-2-one

Downstream raw materials:

3-[(4R,5S,6S,7R)-4,7-Dibenzyl-3-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-2-oxo-[1,3]diazepan-1-ylmethyl]-benzoic acid

3-[(4R,5S,6S,7R)-4,7-Dibenzyl-3-butyl-5,6-bis-(2-methoxy-ethoxymethoxy)-2-oxo-[1,3]diazepan-1-ylmethyl]-N-(1H-imidazol-2-yl)-benzamide

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