Cas no 51521-30-3 (Pyrido[4,3-g]isoquinoline)

Pyrido[4,3-g]isoquinoline structure
Pyrido[4,3-g]isoquinoline structure
Product Name:Pyrido[4,3-g]isoquinoline
CAS No:51521-30-3
MF:C12H8N2
MW:180.205322265625
CID:362087
PubChem ID:22999777
Update Time:2025-04-19

Pyrido[4,3-g]isoquinoline Chemical and Physical Properties

Names and Identifiers

    • Pyrido[4,3-g]isoquinoline
    • SCHEMBL445516
    • 51521-30-3
    • DTXSID60629478
    • Inchi: 1S/C12H8N2/c1-3-13-7-11-6-12-8-14-4-2-10(12)5-9(1)11/h1-8H
    • InChI Key: KNYFJKORPUITSG-UHFFFAOYSA-N
    • SMILES: N1C=CC2C=C3C=CN=CC3=CC=2C=1

Computed Properties

  • Exact Mass: 180.06884
  • Monoisotopic Mass: 180.068748264g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 0
  • Complexity: 185
  • 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: 2.3
  • Topological Polar Surface Area: 25.8?2

Experimental Properties

  • PSA: 25.78
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