Cas no 88917-40-2 (1,3-Propanediamine, N,N,N',N'-tetrakis[2-(2-pyridinyl)ethyl]-)

1,3-Propanediamine, N,N,N',N'-tetrakis[2-(2-pyridinyl)ethyl]- structure
88917-40-2 structure
Product Name:1,3-Propanediamine, N,N,N',N'-tetrakis[2-(2-pyridinyl)ethyl]-
CAS No:88917-40-2
MF:C31H38N6
MW:494.673626422882
CID:619799
PubChem ID:15520569
Update Time:2025-04-19

1,3-Propanediamine, N,N,N',N'-tetrakis[2-(2-pyridinyl)ethyl]- Chemical and Physical Properties

Names and Identifiers

    • 1,3-Propanediamine, N,N,N',N'-tetrakis[2-(2-pyridinyl)ethyl]-
    • N,N,N',N'-tetrakis(2-pyridin-2-ylethyl)propane-1,3-diamine
    • N~1~,N~1~,N~3~,N~3~-Tetrakis[2-(pyridin-2-yl)ethyl]propane-1,3-diamine
    • 88917-40-2
    • SCHEMBL7106696
    • DTXSID60573588
    • Inchi: 1S/C31H38N6/c1-5-18-32-28(10-1)14-24-36(25-15-29-11-2-6-19-33-29)22-9-23-37(26-16-30-12-3-7-20-34-30)27-17-31-13-4-8-21-35-31/h1-8,10-13,18-21H,9,14-17,22-27H2
    • InChI Key: PAVSJKXXDLMPJI-UHFFFAOYSA-N
    • SMILES: N(CCC1C=CC=CN=1)(CCC1C=CC=CN=1)CCCN(CCC1C=CC=CN=1)CCC1C=CC=CN=1

Computed Properties

  • Exact Mass: 494.31579524g/mol
  • Monoisotopic Mass: 494.31579524g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 37
  • Rotatable Bond Count: 16
  • Complexity: 482
  • 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: 4.3
  • Topological Polar Surface Area: 58?2
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