Cas no 188771-79-1 (Propanediamide, N-phenyl-N'-(phenylsulfonyl)-)

Propanediamide, N-phenyl-N'-(phenylsulfonyl)- structure
188771-79-1 structure
Product Name:Propanediamide, N-phenyl-N'-(phenylsulfonyl)-
CAS No:188771-79-1
MF:C15H14N2O4S
MW:318.347662448883
CID:2785832
Update Time:2023-08-07

Propanediamide, N-phenyl-N'-(phenylsulfonyl)- Chemical and Physical Properties

Names and Identifiers

    • Propanediamide, N-phenyl-N'-(phenylsulfonyl)-
    • Inchi: 1S/C15H14N2O4S/c18-14(16-12-7-3-1-4-8-12)11-15(19)17-22(20,21)13-9-5-2-6-10-13/h1-10H,11H2,(H,16,18)(H,17,19)
    • InChI Key: REIPQNNPAWNJCK-UHFFFAOYSA-N
    • SMILES: S(C1C=CC=CC=1)(NC(CC(NC1C=CC=CC=1)=O)=O)(=O)=O

Computed Properties

  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 5
  • Complexity: 486
  • XLogP3: 2.6
  • Topological Polar Surface Area: 101
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