Cas no 817200-27-4 (3-(4-Fluorophenyl)-5-nitro-1H-indazole)

3-(4-Fluorophenyl)-5-nitro-1H-indazole is a fluorinated nitroindazole derivative with potential applications in medicinal chemistry and pharmaceutical research. Its structural features, including the 4-fluorophenyl and nitro groups, make it a valuable intermediate for the synthesis of biologically active compounds, particularly in the development of kinase inhibitors and other therapeutic agents. The compound exhibits favorable physicochemical properties, such as moderate solubility and stability, facilitating its use in experimental studies. Its well-defined molecular structure allows for precise modifications, enabling researchers to explore structure-activity relationships. This compound is particularly useful in high-throughput screening and drug discovery programs targeting enzyme modulation or signal transduction pathways.
3-(4-Fluorophenyl)-5-nitro-1H-indazole structure
817200-27-4 structure
Product Name:3-(4-Fluorophenyl)-5-nitro-1H-indazole
CAS No:817200-27-4
MF:C13H8FN3O2
MW:257.219925880432
CID:1034127
PubChem ID:53439742
Update Time:2025-06-08

3-(4-Fluorophenyl)-5-nitro-1H-indazole Chemical and Physical Properties

Names and Identifiers

    • 3-(4-Fluorophenyl)-5-nitro-1H-indazole
    • J-510705
    • SCHEMBL2568062
    • DTXSID50702128
    • 817200-27-4
    • ZUQCLDXSHAPHMD-UHFFFAOYSA-N
    • A840185
    • DB-293633
    • Inchi： 1S/C13H8FN3O2/c14-9-3-1-8(2-4-9)13-11-7-10(17(18)19)5-6-12(11)15-16-13/h1-7H,(H,15,16)
    • InChI Key： ZUQCLDXSHAPHMD-UHFFFAOYSA-N
    • SMILES： FC1C=CC(=CC=1)C1C2C=C(C=CC=2NN=1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 257.06005467g/mol
  • Monoisotopic Mass: 257.06005467g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 341
  • 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: 3.1
  • Topological Polar Surface Area: 74.5?2

3-(4-Fluorophenyl)-5-nitro-1H-indazole Pricemore >>

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