Application of 19F quantitative NMR to pharmaceutical analysis

IF 0.4 4区 化学 Q4 CHEMISTRY, PHYSICAL
Allison O. Mattes, David Russell, Evgeny Tishchenko, Yanzhou Liu, Robert H. Cichewicz, Sarah J. Robinson
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引用次数: 13

Abstract

The presence of fluorine in an active pharmaceutical ingredient (API) can impart important pharmacological attributes with regards to metabolism, stability, and selectivity. As such, nearly one-third of newly approved small molecule drugs contain at least one fluorine atom. 19F is 100% naturally abundant lending to virtually unimpeded detection of fluorine-containing molecules, even in complex mixtures. Despite these promising characteristics, the thorough evaluation of a method for 19F qNMR (quantitative NMR) has been lacking. Herein we present experimental methodology and optimized parameters for uniform quantitative sampling of fluorine-containing drugs and we compare results obtained using both gravimetric and absolute concentration methods for data reduction.

19F定量核磁共振在药物分析中的应用
活性药物成分(API)中氟的存在可以赋予代谢、稳定性和选择性方面的重要药理学属性。因此,近三分之一新批准的小分子药物至少含有一个氟原子。19F是100%天然丰富的,即使在复杂的混合物中,也几乎不受阻碍地检测含氟分子。尽管有这些有希望的特征,但对19F qNMR(定量NMR)方法的全面评估一直缺乏。本文提出了含氟药物均匀定量取样的实验方法和优化参数,并对重量法和绝对浓度法的结果进行了数据简化比较。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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来源期刊
CiteScore
0.90
自引率
0.00%
发文量
12
审稿时长
>12 weeks
期刊介绍: Concepts in Magnetic Resonance Part A brings together clinicians, chemists, and physicists involved in the application of magnetic resonance techniques. The journal welcomes contributions predominantly from the fields of magnetic resonance imaging (MRI), nuclear magnetic resonance (NMR), and electron paramagnetic resonance (EPR), but also encourages submissions relating to less common magnetic resonance imaging and analytical methods. Contributors come from academic, governmental, and clinical communities, to disseminate the latest important experimental results from medical, non-medical, and analytical magnetic resonance methods, as well as related computational and theoretical advances. Subject areas include (but are by no means limited to): -Fundamental advances in the understanding of magnetic resonance -Experimental results from magnetic resonance imaging (including MRI and its specialized applications) -Experimental results from magnetic resonance spectroscopy (including NMR, EPR, and their specialized applications) -Computational and theoretical support and prediction for experimental results -Focused reviews providing commentary and discussion on recent results and developments in topical areas of investigation -Reviews of magnetic resonance approaches with a tutorial or educational approach
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