(E)-N-(5-chloro-2-{3-[3-(4-fluorobenzyl)-3,7,9-triazabicyclo[3.3.1]non-9-yl]-3-oxo-propenyl}-phenyl)-acetamide

Base Information

Chemical Name:(E)-N-(5-chloro-2-{3-[3-(4-fluorobenzyl)-3,7,9-triazabicyclo[3.3.1]non-9-yl]-3-oxo-propenyl}-phenyl)-acetamide
CAS No.:868407-48-1
Molecular Formula:C₂₄H₂₆ClFN₄O₂
Molecular Weight:456.947
Hs Code.:

Synonyms:(E)-N-(5-chloro-2-{3-[3-(4-fluorobenzyl)-3,7,9-triazabicyclo[3.3.1]non-9-yl]-3-oxo-propenyl}-phenyl)-acetamide

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Chemical Property of (E)-N-(5-chloro-2-{3-[3-(4-fluorobenzyl)-3,7,9-triazabicyclo[3.3.1]non-9-yl]-3-oxo-propenyl}-phenyl)-acetamide

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Technology Process of (E)-N-(5-chloro-2-{3-[3-(4-fluorobenzyl)-3,7,9-triazabicyclo[3.3.1]non-9-yl]-3-oxo-propenyl}-phenyl)-acetamide

There total 9 articles about (E)-N-(5-chloro-2-{3-[3-(4-fluorobenzyl)-3,7,9-triazabicyclo[3.3.1]non-9-yl]-3-oxo-propenyl}-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: 90.0%

: 868407-53-8
(E)-9-[3-(2-acetylamino-4-chlorophenyl)-acryloyl]-7-(4-fluorobenzyl)-3,7,9-triazabicyclo[3.3.1]nonane-3-carboxylic acid tert-butyl ester

: 868407-48-1
(E)-N-(5-chloro-2-{3-[3-(4-fluorobenzyl)-3,7,9-triazabicyclo[3.3.1]non-9-yl]-3-oxo-propenyl}-phenyl)-acetamide

Guidance literature:: (E)-9-[3-(2-acetylamino-4-chlorophenyl)-acryloyl]-7-(4-fluorobenzyl)-3,7,9-triazabicyclo[3.3.1]nonane-3-carboxylic acid tert-butyl ester; With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 0.0833333h;

With sodium hydroxide; sodium carbonate; In ethanol; dichloromethane; water;

Reference yield:

: 868407-40-3
7,9-dibenzyl-3,7,9-triazabicyclo[3.3.1]nonane-3-carboxylic acid tert-butyl ester

: 868407-48-1
(E)-N-(5-chloro-2-{3-[3-(4-fluorobenzyl)-3,7,9-triazabicyclo[3.3.1]non-9-yl]-3-oxo-propenyl}-phenyl)-acetamide

Guidance literature:: Multi-step reaction with 6 steps

1: hydrogen / palladium 10% on activated carbon / ethanol / 4 h / 20 °C / 760.05 Torr

2: sodium hydrogencarbonate / ethanol / 2 h / Heating / reflux

3: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / dichloromethane / 2 h / 20 °C

4: sodium hydroxide; ethanol; water / 1.5 h / Heating / reflux

5: triethylamine / tetrahydrofuran / 0.5 h / Heating / reflux

6: trifluoroacetic acid / dichloromethane / 0.08 h / 20 °C

With sodium hydroxide; ethanol; water; hydrogen; sodium hydrogencarbonate; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; trifluoroacetic acid; palladium 10% on activated carbon; In tetrahydrofuran; ethanol; dichloromethane;

Reference yield:

: 864448-31-7
3,9-dibenzyl-3,7,9-triazabicyclo[3.3.1]nonane

: 868407-48-1
(E)-N-(5-chloro-2-{3-[3-(4-fluorobenzyl)-3,7,9-triazabicyclo[3.3.1]non-9-yl]-3-oxo-propenyl}-phenyl)-acetamide

Guidance literature:: Multi-step reaction with 7 steps

1: tert-butyl methyl ether / 0.17 h / 20 °C

2: hydrogen / palladium 10% on activated carbon / ethanol / 4 h / 20 °C / 760.05 Torr

3: sodium hydrogencarbonate / ethanol / 2 h / Heating / reflux

4: 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / dichloromethane / 2 h / 20 °C

5: sodium hydroxide; ethanol; water / 1.5 h / Heating / reflux

6: triethylamine / tetrahydrofuran / 0.5 h / Heating / reflux

7: trifluoroacetic acid / dichloromethane / 0.08 h / 20 °C

With sodium hydroxide; ethanol; water; hydrogen; sodium hydrogencarbonate; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; trifluoroacetic acid; palladium 10% on activated carbon; In tetrahydrofuran; ethanol; dichloromethane; tert-butyl methyl ether;