Cas no 35317-91-0 (Thiazolo[5,4-h]isoquinoline-2,5-diamine)

Thiazolo[5,4-h]isoquinoline-2,5-diamine structure
35317-91-0 structure
Product Name:Thiazolo[5,4-h]isoquinoline-2,5-diamine
CAS No:35317-91-0
MF:C10H8N4S
MW:216.262319564819
CID:295568
PubChem ID:45077607
Update Time:2025-04-19

Thiazolo[5,4-h]isoquinoline-2,5-diamine Chemical and Physical Properties

Names and Identifiers

    • Thiazolo[5,4-h]isoquinoline-2,5-diamine
    • Thiazolo[5,4-h]isoquinoline-2,5-diamine (9CI)
    • [1,3]thiazolo[5,4-h]isoquinoline-2,5-diamine
    • 35317-91-0
    • Thiazolo[5,4-h]isoquinoline-2,5-diamine(9ci)
    • DTXSID10663342
    • Inchi: 1S/C10H8N4S/c11-7-3-8-9(14-10(12)15-8)6-4-13-2-1-5(6)7/h1-4H,11H2,(H2,12,14)
    • InChI Key: IQLYCMQTKMFFBP-UHFFFAOYSA-N
    • SMILES: S1C(N)=NC2=C1C=C(C1C=CN=CC=12)N

Computed Properties

  • Exact Mass: 216.04714
  • Monoisotopic Mass: 216.047
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 0
  • Complexity: 250
  • 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
  • Topological Polar Surface Area: 106A^2
  • XLogP3: 1.5

Experimental Properties

  • PSA: 77.82
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