2-[(4-Sulfamoylphenyl)formamido]acetic acid

Base Information

• Chemical Name: 2-[(4-Sulfamoylphenyl)formamido]acetic acid
• CAS No.: 143288-21-5
• Molecular Formula: C9H10N2O5S
• Molecular Weight: 258.255
• DSSTox Substance ID: DTXSID20440429
• Nikkaji Number: J1.563.958J
• Wikidata: Q82256734
• Pharos Ligand ID: TSHTFSYM3VUY
• ChEMBL ID: CHEMBL51385
• Mol file: 143288-21-5.mol

Synonyms:143288-21-5;2-[(4-sulfamoylphenyl)formamido]acetic acid;2-[(4-sulfamoylbenzoyl)amino]acetic Acid;2-(4-Sulfamoylbenzamido)acetic acid;CHEMBL51385;[[4-(Aminosulfonyl)benzoyl]amino]acetic acid;{[4-(aminosulfonyl)benzoyl]amino}acetic acid;Glycine, N-[4-(aminosulfonyl)benzoyl]-;N-(4-Sulfamoylbenzoyl)glycine;DTXSID20440429;2-(4-Sulfamoylbenzamido)aceticacid;BDBM50101343;AKOS000146229;(4-Sulfamoyl-benzoylamino)-acetic acid;EN300-61056;Z53021528

Chemical Property of 2-[(4-Sulfamoylphenyl)formamido]acetic acid

Chemical Property:

• XLogP3: -1.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 258.03104260
• Heavy Atom Count: 17
• Complexity: 392

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C(=O)NCC(=O)O)S(=O)(=O)N

Technology Process of 2-[(4-Sulfamoylphenyl)formamido]acetic acid

There total 3 articles about 2-[(4-Sulfamoylphenyl)formamido]acetic acid 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:

4-(aminosulfonyl)-benzoic acid (138-41-0) → (4-Sulfamoyl-benzoylamino)-acetic acid (143288-21-5)

Guidance literature:

Multi-step reaction with 2 steps

1: 73 percent / dicyclohexylcarbodiimide / dioxane; dimethylformamide / 5 °C

2: acetone; various solvent(s) / 2 h / 20 °C / pH 7.0 - 7.5

With dicyclohexyl-carbodiimide; In 1,4-dioxane; N,N-dimethyl-formamide; acetone;

DOI:10.1002/chem.200305391

Reference yield:

glycine (56-40-6,18875-39-3,25718-94-9) + 4-uulfamoyl-benzoic acid 2,5-dioxo-pyrrolidin-1-yl ester (154715-61-4) → (4-Sulfamoyl-benzoylamino)-acetic acid (143288-21-5)

Guidance literature:

With potassium dihydrogenphosphate; In acetone; for 2h; Ambient temperature;

DOI:10.1021/ja00091a005

Reference yield:

(4-sulfamoyl-benzoylamino)-acetic acid tert-butyl ester → (4-Sulfamoyl-benzoylamino)-acetic acid (143288-21-5)

Guidance literature:

With trifluoroacetic acid; In dichloromethane; at 0 ℃; for 1h;

DOI:10.1016/S0960-894X(01)00303-1

upstream raw materials:

glycine

4-uulfamoyl-benzoic acid 2,5-dioxo-pyrrolidin-1-yl ester

4-(aminosulfonyl)-benzoic acid

Downstream raw materials:

(4-Sulfamoyl-benzoylamino)-acetic acid 2,5-dioxo-pyrrolidin-1-yl ester

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