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Synthesis, Characterization and Molecular Docking Study of Novel Chalcone Derivative as Potential Anticancer Agent

Author

Listed:
  • Gopala Krishna Murthy H.R

    (Government First Grade College, Nanjangud, Karnataka)

  • Shubha S

    (Government First Grade College, Malleshwaram, Bangalore, Karnataka)

Abstract

A series of novel chalcone derivatives were synthesized via Claisen–Schmidt condensation and evaluated through spectroscopic characterization and molecular docking studies. The synthesized compounds were characterized using Fourier Transform Infrared Spectroscopy (FT-IR), Proton Nuclear Magnetic Resonance (¹H NMR), and Mass spectroscopy. Molecular docking analysis was performed to evaluate binding interactions with the Epidermal Growth Factor Receptor (EGFR), a validated anticancer target. The docking results revealed favourable binding affinities ranging from –7.5 to –9.2 kcal/mol, supported by hydrogen bonding and hydrophobic interactions within the active site. The findings suggest that the synthesized chalcone derivatives possess promising anticancer potential and warrant further biological evaluation.

Suggested Citation

  • Gopala Krishna Murthy H.R & Shubha S, 2026. "Synthesis, Characterization and Molecular Docking Study of Novel Chalcone Derivative as Potential Anticancer Agent," International Journal of Latest Technology in Engineering, Management & Applied Science, RSIS International, vol. 15(2), pages 1115-1119, February.
    • Handle: RePEc:bjf:ijltem:v:15:y:2026:i:2:a:2109
    DOI: 10.51583/IJLTEMAS.2026.15020000098
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