Cas no 1428532-93-7 (8-chloro-6-(trifluoromethyl)-1,2,4triazolo4,3-apyridin-3(2H)-one)

8-Chloro-6-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyridin-3(2H)-one is a heterocyclic compound featuring a fused triazolopyridine core with chloro and trifluoromethyl substituents. Its unique structure imparts significant reactivity and potential utility in pharmaceutical and agrochemical applications. The trifluoromethyl group enhances lipophilicity and metabolic stability, while the chloro substitution offers a handle for further functionalization. This compound serves as a versatile intermediate in the synthesis of biologically active molecules, particularly in the development of kinase inhibitors and antimicrobial agents. Its well-defined chemical properties and synthetic accessibility make it a valuable building block for medicinal chemistry research. Proper handling and storage under inert conditions are recommended due to its reactive functional groups.
8-chloro-6-(trifluoromethyl)-1,2,4triazolo4,3-apyridin-3(2H)-one structure
1428532-93-7 structure
Product Name:8-chloro-6-(trifluoromethyl)-1,2,4triazolo4,3-apyridin-3(2H)-one
CAS No:1428532-93-7
MF:C7H3ClF3N3O
MW:237.566430330276
MDL:MFCD12406875
CID:3163920
PubChem ID:74891415
Update Time:2025-10-28

8-chloro-6-(trifluoromethyl)-1,2,4triazolo4,3-apyridin-3(2H)-one Chemical and Physical Properties

Names and Identifiers

    • 8-Chloro-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
    • ZEWPPMJHVMHLHL-UHFFFAOYSA-N
    • DTXSID901157859
    • D79840
    • 8-CHLORO-6-(TRIFLUOROMETHYL)-2H-[1,2,4]TRIAZOLO[4,3-A]PYRIDIN-3-ONE
    • 1428532-93-7
    • 8-chloro-6-(trifluoromethyl)-2H,3H-[1,2,4]triazolo[4,3-a]pyridin-3-one
    • 1,2,4-Triazolo[4,3-a]pyridin-3(2H)-one, 8-chloro-6-(trifluoromethyl)-
    • SCHEMBL19152183
    • MFCD12406875
    • AKOS027422314
    • GS-1015
    • 8-chloro-6-(trifluoromethyl)-1,2,4triazolo4,3-apyridin-3(2H)-one
    • MDL: MFCD12406875
    • Inchi: 1S/C7H3ClF3N3O/c8-4-1-3(7(9,10)11)2-14-5(4)12-13-6(14)15/h1-2H,(H,13,15)
    • InChI Key: ZEWPPMJHVMHLHL-UHFFFAOYSA-N
    • SMILES: ClC1=CC(C(F)(F)F)=CN2C(NN=C21)=O

Computed Properties

  • Exact Mass: 236.9916739g/mol
  • Monoisotopic Mass: 236.9916739g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 0
  • Complexity: 424
  • 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: 1.3
  • Topological Polar Surface Area: 44.7?2

8-chloro-6-(trifluoromethyl)-1,2,4triazolo4,3-apyridin-3(2H)-one Pricemore >>

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