Cas no 17051-85-3 (Methanediamine,N,N'-bis(p-sulfanilylphenyl)- (8CI))

Methanediamine,N,N'-bis(p-sulfanilylphenyl)- (8CI) structure
17051-85-3 structure
Product Name:Methanediamine,N,N'-bis(p-sulfanilylphenyl)- (8CI)
CAS No:17051-85-3
MF:C25H24N4O4S2
MW:508.612462997437
CID:190468
PubChem ID:234405
Update Time:2025-04-19

Methanediamine,N,N'-bis(p-sulfanilylphenyl)- (8CI) Chemical and Physical Properties

Names and Identifiers

    • Methanediamine,N,N'-bis(p-sulfanilylphenyl)- (8CI)
    • 2,3-bis(bromomethyl)oxirane
    • 17051-85-3
    • DTXSID70937778
    • N,N'-Bis[4-(4-aminobenzene-1-sulfonyl)phenyl]methanediamine
    • NSC34241
    • NSC-34241
    • Inchi: 1S/C25H24N4O4S2/c26-18-1-9-22(10-2-18)34(30,31)24-13-5-20(6-14-24)28-17-29-21-7-15-25(16-8-21)35(32,33)23-11-3-19(27)4-12-23/h1-16,28-29H,17,26-27H2
    • InChI Key: VADVTIFAQQSRHF-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(=CC=1)N)(C1C=CC(=CC=1)NCNC1C=CC(=CC=1)S(C1C=CC(=CC=1)N)(=O)=O)(=O)=O

Computed Properties

  • Exact Mass: 508.12412
  • Monoisotopic Mass: 508.12389761g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 35
  • Rotatable Bond Count: 8
  • Complexity: 782
  • 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: 3.9
  • Topological Polar Surface Area: 161?2

Experimental Properties

  • PSA: 144.38
  • LogP: 7.46810
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