Cas no 314-99-8 (7H-Benzo[e][1]benzothieno[3,2-b]indole)

7H-Benzo[e][1]benzothieno[3,2-b]indole structure
314-99-8 structure
Product Name:7H-Benzo[e][1]benzothieno[3,2-b]indole
CAS No:314-99-8
MF:C18H11NS
MW:273.351642847061
CID:321645
PubChem ID:71361461
Update Time:2025-04-19

7H-Benzo[e][1]benzothieno[3,2-b]indole Chemical and Physical Properties

Names and Identifiers

    • 7H-Benzo[e][1]benzothieno[3,2-b]indole
    • 4,5-Benzothianaphtheno[3',2':2,3]indole
    • 7H-benzo[e]benzo[4,5]thieno[3,2-b]indole
    • SCHEMBL16482692
    • 314-99-8
    • DTXSID60785144
    • Inchi: 1S/C18H11NS/c1-2-6-12-11(5-1)9-10-14-16(12)18-17(19-14)13-7-3-4-8-15(13)20-18/h1-10,19H
    • InChI Key: YOUSHHFZKASOIT-UHFFFAOYSA-N
    • SMILES: S1C2C=CC=CC=2C2=C1C1C3C=CC=CC=3C=CC=1N2

Computed Properties

  • Exact Mass: 273.06122053g/mol
  • Monoisotopic Mass: 273.06122053g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 0
  • Complexity: 384
  • 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: 5.7
  • Topological Polar Surface Area: 44?2
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