5626-92-6

Basic information

• Product Name: 4-AMINO-N-FURAN-2-YLMETHYL-BENZENESULFONAMIDE
• Synonyms: 4-AMINO-N-FURAN-2-YLMETHYL-BENZENESULFONAMIDE;OTAVA-BB BB7020361168
• CAS NO: 5626-92-6
• Molecular Formula: C₁₁H₁₂N₂O₃S
• Molecular Weight: 252.29
• Mol File: 5626-92-6.mol
• Article Data: 1

Chemical Properties

• Melting Point: 153 °C(Solv: water (7732-18-5))
• Boiling Point: 454.5 °C at 760 mmHg
• Flash Point: 228.7 °C
• Appearance: /
• Density: 1.357g/cm³
• Vapor Pressure: 1.89E-08mmHg at 25°C
• Refractive Index: 1.612
• PKA: 11.18±0.50(Predicted)
• CAS DataBase Reference: 4-AMINO-N-FURAN-2-YLMETHYL-BENZENESULFONAMIDE(CAS DataBase Reference)
• NIST Chemistry Reference: 4-AMINO-N-FURAN-2-YLMETHYL-BENZENESULFONAMIDE(5626-92-6)
• EPA Substance Registry System: 4-AMINO-N-FURAN-2-YLMETHYL-BENZENESULFONAMIDE(5626-92-6)

Safety Data

• Hazard Codes: Xi
• Statements: 36
• Safety Statements: 26
• HazardClass: IRRITANT
• Hazardous Substances Data: 5626-92-6(Hazardous Substances Data)

Usage

General Description

4-Amino-N-Furan-2-ylmethyl-benzenesulfonamide is a chemical compound that belongs to the category of organic compounds known as benzenesulfonamides. These are organic compounds containing a sulfonamide group that is S-linked to a benzene ring. Its structure comprises an aromatic benzene ring attached to a furan ring via a sulfonamide linkage. It could potentially have a range of applications in the pharmaceutical industry due to the biological activity attributed to sulfonamides, although its particular use and properties would be subject to further research. As with all chemical compounds, careful handling, storage, and usage are required to ensure safety.

InChI:InChI=1/C11H12N2O3S/c12-9-3-5-11(6-4-9)17(14,15)13-8-10-2-1-7-16-10/h1-7,13H,8,12H2

Upstream product

• 98-74-8 4-Nitrobenzenesulfonyl chloride 
• 121-60-8 p-acetylaminobenzenesulfonyl chloride 
• 617-89-0 furan-2-ylmethanamine 
• 321531-94-6 N-acetyl-sulfanilic acid furfurylamide 

Relevant articles and documents

Potent and selective N-(4-sulfamoylphenyl)thiourea-based GPR55 agonists

To date, many known G protein-coupled receptor 55 (GPR55) ligands are those identified among the cannabinoids. In order to further study the function of GPR55, new potent and selective ligands are needed. In this study, we utilized the screening results from PubChem bioassay AID 1961 which reports the results of Image-based HTS for Selective Agonists of GPR55. Three compounds, CID1792579, CID1252842 and CID1011163, were further evaluated and used as a starting point to create a series of nanomolar potency GPR55 agonists with N-(4-sulfamoylphenyl)thiourea scaffold. The GPR55 activity of the compounds were screened by using a commercial β-arrestin PathHunter assay and the potential compounds were further evaluated by using a recombinant HEK cell line exhibiting GPR55-mediated effects on calcium signalling. The designed compounds were not active when tested against various endocannabinoid targets (CB1R, CB2R, FAAH, MGL, ABHD6 and ABHD12), indicating compounds' selectivity for the GPR55. Finally, structure-activity relationships of these compounds were explored.