2,5-Dioxopyrrolidin-1-yl 4-sulfamoylbenzoate

Base Information

• Chemical Name: 2,5-Dioxopyrrolidin-1-yl 4-sulfamoylbenzoate
• CAS No.: 154715-61-4
• Molecular Formula: C11H10N2O6S
• Molecular Weight: 298.276
• DSSTox Substance ID: DTXSID10604972
• Nikkaji Number: J1.768.769G
• Wikidata: Q82503064
• Mol file: 154715-61-4.mol

Synonyms:2,5-Dioxopyrrolidin-1-yl 4-sulfamoylbenzoate;154715-61-4;SCHEMBL12884225;DTXSID10604972;DB-134141;4-{[(2,5-Dioxopyrrolidin-1-yl)oxy]carbonyl}benzene-1-sulfonamide

Chemical Property of 2,5-Dioxopyrrolidin-1-yl 4-sulfamoylbenzoate

Chemical Property:

• XLogP3: -0.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 298.02595722
• Heavy Atom Count: 20
• Complexity: 514

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(=O)N(C1=O)OC(=O)C2=CC=C(C=C2)S(=O)(=O)N

Technology Process of 2,5-Dioxopyrrolidin-1-yl 4-sulfamoylbenzoate

There total 1 articles about 2,5-Dioxopyrrolidin-1-yl 4-sulfamoylbenzoate 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: 87.0%

1-hydroxy-pyrrolidine-2,5-dione (6066-82-6) + 4-(aminosulfonyl)-benzoic acid (138-41-0) → 4-uulfamoyl-benzoic acid 2,5-dioxo-pyrrolidin-1-yl ester (154715-61-4)

Guidance literature:

With 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃; for 4h; Inert atmosphere;

Reference yield: 98.0%

C20H24N2O2 + 4-uulfamoyl-benzoic acid 2,5-dioxo-pyrrolidin-1-yl ester (154715-61-4) → benzyl N-benzyl-N-[1-(4-sulfamoylbenzoyl)piperidin-4-yl]carbamate

Guidance literature:

at 20 ℃;

DOI:10.1016/j.bioorg.2019.103130

Reference yield: 97.0%

5-tert-butoxycarbonylamino-1-aminopentane (51644-96-3) + 4-uulfamoyl-benzoic acid 2,5-dioxo-pyrrolidin-1-yl ester (154715-61-4) → C17H27N3O5S (1315482-72-4)

Guidance literature:

In N,N-dimethyl-formamide; at 20 ℃; for 3h; Inert atmosphere;

DOI:10.1021/ja203996c

upstream raw materials:

1-hydroxy-pyrrolidine-2,5-dione

4-(aminosulfonyl)-benzoic acid

Downstream raw materials:

1-<((glycylglycyl)glycyl)carbonyl>-4-sulfamoylbenzene

[2-(4-Sulfamoyl-benzoylamino)-acetylamino]-acetic acid