Study of solute-solvent intermolecular interactions and preferential solvation for mevastatin dissolution in pure and mixed binary solvents

被引:1
|
作者
Zhou, Guoquan [1 ]
机构
[1] Ningbo Univ Technol, Sch Mat & Chem Engn, Ningbo 315211, Zhejiang, Peoples R China
来源
关键词
Mevastatin; Solubility parameter; Molecular force; Thermodynamic framework; HMG-COA REDUCTASE; ETHYL-ACETATE MIXTURES; MIXING PROPERTIES; SOLUBILITY; INDOMETHACIN; CELLS; WATER; ACID;
D O I
10.1016/j.jct.2022.106884
中图分类号
O414.1 [热力学];
学科分类号
摘要
The solute-solvent and solvent-solvent interactions between mevastatin and different solvents were studied. In pure solvent, the largest solubility was found in 2-butanone (2.592x10- 2) and minimum in cyclohexane (5.068x10- 5) at 318.15 K. The non-specific and hydrogen bonding interactions including the dipolarity/ polarizability (pi*), Hildebrand solubility parameter (delta H), hydrogen bond acidity (alpha) and hydrogen bond basicity (beta) were analyzed. In mixture of (ethyl acetate + ethanol), the maximum solubility (2.144x10- 2) is observed in 80%: 20% w/w of ethyl acetate: ethanol. Almost the same interaction energy and equilibrium mixing energy between solute and solvent promote the occurrence of co-solvency phenomenon. Moreover, according to the preferential solvation results, it is conjecturable that in intermediate composition mixtures and ethyl acetate-rich mixtures, mevastatin molecules are acting mainly as Lewis acid and Lewis base, respectively. Meanwhile, two thermodynamic models including modified Apelblat equation and Jouyban-Acree model are suitable to evaluate the dissolution profile, and the maximum value of relative average deviation is no > 5%. The apparent ther-modynamic properties of dissolution process in all investigated solvents are calculated which suggest that dissolution process is an endothermic process.
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页数:8
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