Cas no 55454-84-7 (Benzamide, 4-amino-N-(phenylsulfonyl)-)

Benzamide, 4-amino-N-(phenylsulfonyl)- structure
55454-84-7 structure
Product Name:Benzamide, 4-amino-N-(phenylsulfonyl)-
CAS No:55454-84-7
MF:C13H12N2O3S
MW:276.310981750488
CID:1597168
PubChem ID:12876556
Update Time:2025-04-21

Benzamide, 4-amino-N-(phenylsulfonyl)- Chemical and Physical Properties

Names and Identifiers

    • Benzamide, 4-amino-N-(phenylsulfonyl)-
    • SCHEMBL8660071
    • 55454-84-7
    • 4-Amino-N-(phenylsulfonyl)benzamide
    • N-(benzenesulfonyl)-p-aminobenzamide
    • starbld0015357
    • RQIOJOHMHGTMCH-UHFFFAOYSA-N
    • Inchi: 1S/C13H12N2O3S/c14-11-8-6-10(7-9-11)13(16)15-19(17,18)12-4-2-1-3-5-12/h1-9H,14H2,(H,15,16)
    • InChI Key: RQIOJOHMHGTMCH-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=CC=1)(NC(C1C=CC(=CC=1)N)=O)(=O)=O

Computed Properties

  • Exact Mass: 276.05696
  • Monoisotopic Mass: 276.05686342g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 3
  • Complexity: 402
  • 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: 0.7
  • Topological Polar Surface Area: 97.6?2

Experimental Properties

  • PSA: 89.26
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