Atropisomeric Racemization Kinetics of MRTX1719 Using Chiral Solvating Agent-Assisted 19F NMR Spectroscopy
Svitlana Kulyk, Susan M. De Paul, Matthew A. Marx and 2 more
ACS Omega · 2022
doi:10.1021/acsomega.2c03316 (opens in a new tab)
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Abstract
High Resolution Image Download MS PowerPoint Slide With renewed interest in atropisomerism of drug molecules, efficient methods to experimentally determine torsion rotational energy barriers are needed. Here, we describe use of the chiral phosphoric acid solvating agent (+)-TiPSY to resolve the signals of atropisomers in 19 F NMR and to use the data to study the kinetics of racemization and determine the rotational energy barrier of clinical compound MRTX1719 . This method is complimentary to traditional chiral high-performance liquid chromatography (HPLC) and enhances the toolkit for chiral analysis techniques.
Abstract licence: CC BY-NC-ND
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