N-(3-[2-(3-oxo-1,4-diazepan-1-yl)-1,3-thiazol-5-yl]-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)acetamide

Base Information

Chemical Name:N-(3-[2-(3-oxo-1,4-diazepan-1-yl)-1,3-thiazol-5-yl]-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)acetamide
CAS No.:1312572-16-9
Molecular Formula:C₂₁H₂₀F₃N₇O₂S
Molecular Weight:491.497
Hs Code.:

Synonyms:N-(3-[2-(3-oxo-1,4-diazepan-1-yl)-1,3-thiazol-5-yl]-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)acetamide

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Chemical Property of N-(3-[2-(3-oxo-1,4-diazepan-1-yl)-1,3-thiazol-5-yl]-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)acetamide

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Technology Process of N-(3-[2-(3-oxo-1,4-diazepan-1-yl)-1,3-thiazol-5-yl]-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)acetamide

There total 10 articles about N-(3-[2-(3-oxo-1,4-diazepan-1-yl)-1,3-thiazol-5-yl]-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)acetamide 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: 73.0%

: 1312572-79-4
tert-butyl {3-(acetylamino)-5-[2-(3-oxo-1,4-diazepan-1-yl)-1,3-thiazol-5-yl]phenyl}[4-(trifluoromethyl)pyrimidin-2-yl]carbamate

: 1312572-16-9
N-(3-[2-(3-oxo-1,4-diazepan-1-yl)-1,3-thiazol-5-yl]-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)acetamide

Guidance literature:: With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 1h; Inert atmosphere;

Reference yield:

: 44981-94-4
N-cyanoethyl glycine ethyl ester

: 1312572-16-9
N-(3-[2-(3-oxo-1,4-diazepan-1-yl)-1,3-thiazol-5-yl]-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)acetamide

Guidance literature:: Multi-step reaction with 10 steps

1.1: chloroform / 20 °C

2.1: hydrogen; ammonia / Rany-Ni / ethanol / 5 h / 20 °C

3.1: sodium methylate; methanol / 1.5 h / Reflux

4.1: trifluoroacetic acid / dichloromethane / 10 °C

4.2: 100 °C

5.1: sodium carbonate / tetrakis(triphenylphosphine) palladium⁽⁰⁾ / 1,2-dimethoxyethane; water / 18 h / 100 °C / Inert atmosphere

6.1: caesium carbonate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene / palladium diacetate / 1,4-dioxane / 5 h / 125 °C / Inert atmosphere; sealed tube

7.1: dmap; triethylamine / tetrahydrofuran / 60 h / 20 °C / Inert atmosphere

8.1: ammonium chloride; iron / ethanol; water / 0.5 h / 20 - 40 °C / Inert atmosphere

8.2: 5 h / 40 °C

9.1: triethylamine / dichloromethane / 18 h / 20 °C / Inert atmosphere

10.1: trifluoroacetic acid / dichloromethane / 1 h / 20 °C / Inert atmosphere

With methanol; dmap; ammonia; hydrogen; sodium methylate; iron; sodium carbonate; ammonium chloride; caesium carbonate; triethylamine; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; trifluoroacetic acid; tetrakis(triphenylphosphine) palladium⁽⁰⁾; palladium diacetate; In tetrahydrofuran; 1,4-dioxane; 1,2-dimethoxyethane; ethanol; dichloromethane; chloroform; water;

Reference yield:

: 266353-18-8
N-tert-butoxycarbonyl-2-(2-cyanoethyl)aminoacetic acid ethyl ester

: 1312572-16-9
N-(3-[2-(3-oxo-1,4-diazepan-1-yl)-1,3-thiazol-5-yl]-5-{[4-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)acetamide

Guidance literature:: Multi-step reaction with 9 steps

1.1: hydrogen; ammonia / Rany-Ni / ethanol / 5 h / 20 °C

2.1: sodium methylate; methanol / 1.5 h / Reflux

3.1: trifluoroacetic acid / dichloromethane / 10 °C

3.2: 100 °C

4.1: sodium carbonate / tetrakis(triphenylphosphine) palladium⁽⁰⁾ / 1,2-dimethoxyethane; water / 18 h / 100 °C / Inert atmosphere

5.1: caesium carbonate; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene / palladium diacetate / 1,4-dioxane / 5 h / 125 °C / Inert atmosphere; sealed tube

6.1: dmap; triethylamine / tetrahydrofuran / 60 h / 20 °C / Inert atmosphere

7.1: ammonium chloride; iron / ethanol; water / 0.5 h / 20 - 40 °C / Inert atmosphere

7.2: 5 h / 40 °C

8.1: triethylamine / dichloromethane / 18 h / 20 °C / Inert atmosphere

9.1: trifluoroacetic acid / dichloromethane / 1 h / 20 °C / Inert atmosphere

With methanol; dmap; ammonia; hydrogen; sodium methylate; iron; sodium carbonate; ammonium chloride; caesium carbonate; triethylamine; 4,5-bis(diphenylphosphino)-9,9-dimethylxanthene; trifluoroacetic acid; tetrakis(triphenylphosphine) palladium⁽⁰⁾; palladium diacetate; In tetrahydrofuran; 1,4-dioxane; 1,2-dimethoxyethane; ethanol; dichloromethane; water;