Cas no 852851-90-2 (5-(diethylsulfamoyl)-2-(2-hydroxyethyl)aminobenzoic acid)

5-(Diethylsulfamoyl)-2-(2-hydroxyethyl)aminobenzoic acid is a specialized benzoic acid derivative featuring a diethylsulfamoyl substituent and a hydroxyethylamino functional group. This compound is of interest in pharmaceutical and chemical research due to its potential as an intermediate in the synthesis of biologically active molecules. The sulfonamide moiety enhances its solubility and binding affinity, while the hydroxyethyl group provides additional reactivity for further functionalization. Its well-defined structure and purity make it suitable for applications in medicinal chemistry, particularly in the development of enzyme inhibitors or receptor modulators. The compound’s stability under standard conditions ensures reliable performance in synthetic workflows.
5-(diethylsulfamoyl)-2-(2-hydroxyethyl)aminobenzoic acid structure
852851-90-2 structure
Product Name:5-(diethylsulfamoyl)-2-(2-hydroxyethyl)aminobenzoic acid
CAS No:852851-90-2
MF:C13H20N2O5S
MW:316.373302459717
CID:844338
PubChem ID:4962232
Update Time:2025-06-07

5-(diethylsulfamoyl)-2-(2-hydroxyethyl)aminobenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 5-[(DIETHYLAMINO)SULFONYL]-2-[(2-HYDROXYETHYL)AMINO]BENZOIC ACID
    • 5-(diethylsulfamoyl)-2-(2-hydroxyethyl)aminobenzoic acid
    • Z71176979
    • C13H20N2O5S
    • 5-(N,N-Diethylsulfamoyl)-2-((2-hydroxyethyl)amino)benzoic acid
    • 5-(diethylsulfamoyl)-2-[(2-hydroxyethyl)amino]benzoic acid
    • CS-0233133
    • J-516587
    • SR-01000068487
    • 852851-90-2
    • AKOS027427166
    • 5-(diethylsulfamoyl)-2-(2-hydroxyethylamino)benzoic Acid
    • SR-01000068487-1
    • 5-(N,N-Diethylsulfamoyl)-2-((2-hydroxyethyl)amino)benzoicacid
    • EN300-13104
    • DTXSID601173048
    • G76087
    • MDL: MFCD06655662
    • Inchi: 1S/C13H20N2O5S/c1-3-15(4-2)21(19,20)10-5-6-12(14-7-8-16)11(9-10)13(17)18/h5-6,9,14,16H,3-4,7-8H2,1-2H3,(H,17,18)
    • InChI Key: PDFYTPYMRMERDE-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(=C(C(=O)O)C=1)NCCO)(N(CC)CC)(=O)=O

Computed Properties

  • Exact Mass: 316.10929292g/mol
  • Monoisotopic Mass: 316.10929292g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 8
  • Complexity: 430
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.2
  • Topological Polar Surface Area: 115?2

5-(diethylsulfamoyl)-2-(2-hydroxyethyl)aminobenzoic acid Pricemore >>

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