Pseudoagostic Interaction Based Zirconium Sensing Using 1,2,3-Triazole and Its Anticarcinogenic Potential Evaluation Through In Vitro and In Silico Approach

IF 3.7 2区化学 Q2 CHEMISTRY, APPLIED

Applied Organometallic Chemistry Pub Date : 2025-01-09 DOI:10.1002/aoc.7983

Gurjaspreet Singh, Heena, Sumesh Khurana, Mithun, Baljinder Singh Gill, Deepanjali Baliyan, Vikas, Necmi Dege, Erdoğan Tarcan

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引用次数: 0

Abstract

With excellent yield, high selectivity, and sensitivity new 1,4-disubstituted 1,2,3-triazoles (8a) and (8b) were synthesized via Cu(I) catalyzed click reaction stitching the hydrazone tethered azide moiety with two different alkyne probes. They were subsequently characterized by ¹H NMR, ¹³C NMR, mass spectrometry, and FT-IR spectroscopy. In addition, X-ray crystallography offered the full structural elucidation of compounds (4), (5), and (8a). The optical properties of the designed chemosensor (8a) towards Zr(IV) have been assessed through UV–visible and fluorescence spectroscopy. The LOD values obtained from absorption and emission spectroscopy are 50 and 0.90 nM, respectively. The pseudoagostic interaction between (8a) and Zr(IV) was established using ¹H NMR, mass spectrometry, and FT-IR spectroscopy. (8a) and (8b) exhibited good antioxidant properties with 0.7135 and 0.856 μM IC₅₀ values and also revealed anticarcinogenic action in both in vitro and docking examinations, it may be anticipated that both probes have the potential to act as antitumor drugs.

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来源期刊

Applied Organometallic Chemistry 化学-无机化学与核化学

CiteScore

7.80

自引率

10.30%

发文量

408

审稿时长

2.2 months

期刊介绍： All new compounds should be satisfactorily identified and proof of their structure given according to generally accepted standards. Structural reports, such as papers exclusively dealing with synthesis and characterization, analytical techniques, or X-ray diffraction studies of metal-organic or organometallic compounds will not be considered. The editors reserve the right to refuse without peer review any manuscript that does not comply with the aims and scope of the journal. Applied Organometallic Chemistry publishes Full Papers, Reviews, Mini Reviews and Communications of scientific research in all areas of organometallic and metal-organic chemistry involving main group metals, transition metals, lanthanides and actinides. All contributions should contain an explicit application of novel compounds, for instance in materials science, nano science, catalysis, chemical vapour deposition, metal-mediated organic synthesis, polymers, bio-organometallics, metallo-therapy, metallo-diagnostics and medicine. Reviews of books covering aspects of the fields of focus are also published.