N₁-(2-(6-((4-bromophenyl)thio)-1,3-dioxo-1H-benzo[de]-isoquinolin-2(3H)-yl)ethyl)-N₆-(2-(2-(2-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)amino)ethoxy)ethoxy)ethyl)adipamide

Base Information

• Chemical Name: N₁-(2-(6-((4-bromophenyl)thio)-1,3-dioxo-1H-benzo[de]-isoquinolin-2(3H)-yl)ethyl)-N₆-(2-(2-(2-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)amino)ethoxy)ethoxy)ethyl)adipamide
• CAS No.: 2378801-85-3
• Molecular Formula: C₄₅H₄₅BrN₆O₁₀S
• Molecular Weight: 941.857

Synonyms:

Chemical Property of N₁-(2-(6-((4-bromophenyl)thio)-1,3-dioxo-1H-benzo[de]-isoquinolin-2(3H)-yl)ethyl)-N₆-(2-(2-(2-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)amino)ethoxy)ethoxy)ethyl)adipamide

Chemical Property:

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of N₁-(2-(6-((4-bromophenyl)thio)-1,3-dioxo-1H-benzo[de]-isoquinolin-2(3H)-yl)ethyl)-N₆-(2-(2-(2-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)amino)ethoxy)ethoxy)ethyl)adipamide

There total 6 articles about N₁-(2-(6-((4-bromophenyl)thio)-1,3-dioxo-1H-benzo[de]-isoquinolin-2(3H)-yl)ethyl)-N₆-(2-(2-(2-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)amino)ethoxy)ethoxy)ethyl)adipamide 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: 52.0%

4-({2-[2-(2-aminoethoxy)ethoxy]ethyl}amino)-2-(2,6-dioxopiperidin-3-yl)-2,3-dihydro-1H-isoindole-1,3-dione + C26H23BrN2O5S → N1-(2-(6-((4-bromophenyl)thio)-1,3-dioxo-1H-benzo[de]-isoquinolin-2(3H)-yl)ethyl)-N6-(2-(2-(2-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)amino)ethoxy)ethoxy)ethyl)adipamide (2378801-85-3)

Guidance literature:

With N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; In dichloromethane; at 0 - 20 ℃;

DOI:10.1021/acs.jmedchem.9b00919

Reference yield:

4-bromo-1,8-naphthalenedicarboxylic anhydride (81-86-7) → N1-(2-(6-((4-bromophenyl)thio)-1,3-dioxo-1H-benzo[de]-isoquinolin-2(3H)-yl)ethyl)-N6-(2-(2-(2-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)amino)ethoxy)ethoxy)ethyl)adipamide (2378801-85-3)

Guidance literature:

Multi-step reaction with 5 steps

1: triethylamine / N,N-dimethyl-formamide / 6 h / 85 °C

2: triethylamine / ethanol / 6 h / 80 °C

3: N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate / dichloromethane / 0 - 20 °C

4: sodium hydroxide; water / tetrahydrofuran

5: N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate / dichloromethane / 0 - 20 °C

With water; triethylamine; N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; sodium hydroxide; In tetrahydrofuran; ethanol; dichloromethane; N,N-dimethyl-formamide;

DOI:10.1021/acs.jmedchem.9b00919

Reference yield:

para-bromobenzenethiol (106-53-6) → N1-(2-(6-((4-bromophenyl)thio)-1,3-dioxo-1H-benzo[de]-isoquinolin-2(3H)-yl)ethyl)-N6-(2-(2-(2-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)amino)ethoxy)ethoxy)ethyl)adipamide (2378801-85-3)

Guidance literature:

Multi-step reaction with 5 steps

1: triethylamine / N,N-dimethyl-formamide / 6 h / 85 °C

2: triethylamine / ethanol / 6 h / 80 °C

3: N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate / dichloromethane / 0 - 20 °C

4: sodium hydroxide; water / tetrahydrofuran

5: N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate / dichloromethane / 0 - 20 °C

With water; triethylamine; N-ethyl-N,N-diisopropylamine; N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate; sodium hydroxide; In tetrahydrofuran; ethanol; dichloromethane; N,N-dimethyl-formamide;

DOI:10.1021/acs.jmedchem.9b00919

upstream raw materials:

4-bromo-1,8-naphthalenedicarboxylic anhydride

para-bromobenzenethiol

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