A series of benzimidazole derivatives (
E1–E5
) was synthesized and characterized by FT‐IR and
1
H‐NMR spectroscopy. DFT calculations at the B3LYP/6‐311G(d,p) level were performed to evaluate their electronic properties. Frontier molecular orbital analysis revealed that the HOMO–LUMO energy gap (ΔE) follows th...
Nuaman F. Alheety, Jalali Abbas, S. R. Jasim et al.· Macromolecular Symposia· 0 citations
A series of benzimidazole derivatives (
Y1–Y3
) were synthesized and structurally characterized using FTIR and
1
H‐NMR spectroscopy. Their binding potential toward tyrosinase‐related protein 1 (TYRP1) was evaluated using molecular docking analysis. Among the investigated compounds,
Y2
exhibited the highest bi...
Mohammed H. Alheety, Jubran Al-Hadithi, Mohammed H. Alheety et al.· Macromolecular Symposia· 0 citations
This study reports the synthesis, structural characterization, and molecular docking evaluation of two nitrile‐substituted chalcone derivatives (
N1
and
N2
) prepared via Claisen–Schmidt condensation between alkoxy‐substituted benzaldehydes and 4‐acetylbenzonitrile. The synthesized compounds were characterized...
Nuaman F. Alheety, Bilal J. M. Aldahham, Mudhir Abed Ali et al.· Macromolecular Symposia· 0 citations
The combined evaluation of dual‐target binding and pharmacokinetic profiling highlights the potential of n‐alkoxy chalcone derivatives as multifunctional neuroactive candidates and provides a rational basis for further experimental validation.
Mohammed H. Alheety, M. A. Guma, Mustafa A. Alheety et al.· Macromolecular Symposia· 0 citations
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