Nanoporous metal–organic frameworks
(MOFs) have been gaining
a reputation for their drug delivery applications. In the current
work, MOF-801 was successfully prepared by a facile, cost-efficient,
and environmentally friendly approach through the reaction of ZrCl4 and fumaric acid as organic linkers to deliver 5-fluorouracil
(5-FU). The prepared nanostructure was fully characterized by a series
of analytical techniques including Fourier transform infrared spectroscopy,
powder X-ray diffraction, field-emission scanning electron microscopy,
energy-dispersive X-ray spectroscopy, UV–vis spectroscopy, 1H NMR spectroscopy, thermogravimetric analysis, high-performance
liquid chromatography, and Brunauer–Emmett–Teller analysis.
MOF-801 could be used for the delivery of the anticancer drug 5-FU
due to its high surface area, suitable pore size, and biocompatible
ingredients. Based on in vitro loading and release studies, a high
5-FU loading capacity and pH-dependent drug release behavior were
observed. Moreover, the interactions between the structure of MOFs
and 5-FU were investigated through Monte Carlo simulation calculations.
An in vitro cytotoxicity test was done, and the results indicated
that 5-FU@MOF-801 was more potent than 5-FU on SW480 cancerous cells,
indicating the highlighted role of this drug delivery system. Finally,
the kinetics of drug release was investigated