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CAS 159326-71-3

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Pyrrolo[2,1-f][1,2,4]triazin-4(1H)-one

Description:
Pyrrolo[2,1-f][1,2,4]triazin-4(1H)-one is a heterocyclic organic compound characterized by its unique fused ring structure, which includes a pyrrole and a triazine moiety. This compound typically exhibits a planar configuration, contributing to its potential for π-π stacking interactions, which can influence its solubility and reactivity. The presence of the triazine ring imparts notable stability and can facilitate various chemical reactions, including nucleophilic substitutions. Pyrrolo[2,1-f][1,2,4]triazin-4(1H)-one may also exhibit biological activity, making it of interest in medicinal chemistry and drug development. Its properties, such as solubility, melting point, and spectral characteristics, can vary based on the specific conditions and solvents used. Additionally, the compound's reactivity can be influenced by substituents on the rings, which can modify its electronic properties and interactions with biological targets. Overall, this compound represents a fascinating area of study due to its structural complexity and potential applications in pharmaceuticals and materials science.
Formula:C6H5N3O
InChI:InChI=1S/C6H5N3O/c10-6-5-2-1-3-9(5)8-4-7-6/h1-4H,(H,7,8,10)
InChI key:InChIKey=VYEHSYWBLDTUHX-UHFFFAOYSA-N
SMILES:O=C1C=2N(NC=N1)C=CC2
Synonyms:
  • 1H,4H-Pyrrolo[2,1-f][1,2,4]triazin-4-one
  • 3H,4H-pyrrolo[2,1-f][1,2,4]triazin-4-one
  • 3H-Pyrrolo[2,1-F][1,2,4]Triazin-4-One
  • Pyrrolo[2,1-f]-[1,2,4]triazin-4-ol
  • pyrrolo[2,1-f][1,2,4]triazin-4(3H)-one
  • Pyrrolo[2,1-f][1,2,4]triazin-4(1H)-one
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