2-{4-[4-(3-cyano-2-thioxo-1,2-dihydropyridin-4-yl)-1,4-diazepan-1-yl]phenyl}-N,N-dimethylacetamide

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Chemical Name:2-{4-[4-(3-cyano-2-thioxo-1,2-dihydropyridin-4-yl)-1,4-diazepan-1-yl]phenyl}-N,N-dimethylacetamide
CAS No.:868066-60-8
Molecular Formula:C₂₁H₂₅N₅OS
Molecular Weight:395.528
Hs Code.:

Synonyms:2-{4-[4-(3-cyano-2-thioxo-1,2-dihydropyridin-4-yl)-1,4-diazepan-1-yl]phenyl}-N,N-dimethylacetamide

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Chemical Property of 2-{4-[4-(3-cyano-2-thioxo-1,2-dihydropyridin-4-yl)-1,4-diazepan-1-yl]phenyl}-N,N-dimethylacetamide

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Technology Process of 2-{4-[4-(3-cyano-2-thioxo-1,2-dihydropyridin-4-yl)-1,4-diazepan-1-yl]phenyl}-N,N-dimethylacetamide

There total 4 articles about 2-{4-[4-(3-cyano-2-thioxo-1,2-dihydropyridin-4-yl)-1,4-diazepan-1-yl]phenyl}-N,N-dimethylacetamide 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:

: C₂₀H₂₇N₅OS

: 4637-24-5
N,N-dimethyl-formamide dimethyl acetal

: 868066-60-8
2-{4-[4-(3-cyano-2-thioxo-1,2-dihydropyridin-4-yl)-1,4-diazepan-1-yl]phenyl}-N,N-dimethylacetamide

Guidance literature:: In N,N-dimethyl-formamide; at 20 - 60 ℃; for 1.5h;
DOI:10.1016/j.bmc.2013.01.071

Reference yield:

: 19715-80-1
2-(4-bromophenyl)-N,N-dimethyl acetamide

: 868066-60-8
2-{4-[4-(3-cyano-2-thioxo-1,2-dihydropyridin-4-yl)-1,4-diazepan-1-yl]phenyl}-N,N-dimethylacetamide

Guidance literature:: Multi-step reaction with 4 steps

1: tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; sodium t-butanolate; DavePhos / tert-butyl alcohol; 1,4-dioxane / 2 h / Inert atmosphere; Reflux

2: hydrogen; palladium 10% on activated carbon / ethanol / 1 h / 20 °C

3: N,N-dimethyl-formamide / 0.5 h / 20 °C

4: N,N-dimethyl-formamide / 1.5 h / 20 - 60 °C

With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; palladium 10% on activated carbon; hydrogen; sodium t-butanolate; DavePhos; In 1,4-dioxane; ethanol; N,N-dimethyl-formamide; tert-butyl alcohol;
DOI:10.1016/j.bmc.2013.01.071

Reference yield:

: 868066-56-2
benzyl 4-{4-[2-(dimethylamino)-2-oxoethyl]phenyl}-1,4-diazepane-1-carboxylate

: 868066-60-8
2-{4-[4-(3-cyano-2-thioxo-1,2-dihydropyridin-4-yl)-1,4-diazepan-1-yl]phenyl}-N,N-dimethylacetamide

Guidance literature:: Multi-step reaction with 3 steps

1: hydrogen; palladium 10% on activated carbon / ethanol / 1 h / 20 °C

2: N,N-dimethyl-formamide / 0.5 h / 20 °C

3: N,N-dimethyl-formamide / 1.5 h / 20 - 60 °C

With palladium 10% on activated carbon; hydrogen; In ethanol; N,N-dimethyl-formamide;
DOI:10.1016/j.bmc.2013.01.071