Abstract
An L-proline cocrystal of celecoxib was identified based on a computational approach for predicting crystal mechanical properties in order to significantly reduce the punch sticking propensity of celecoxib. The reduced punch sticking propensity of this cocrystal was attributed to both reduced plasticity through deactivating slip planes and minimizing exposure of high electronegative functional groups to the punch tip during compression. This material-sparing and reliable approach of integrated computational and experimental investigation of punch sticking holds promise in crystal engineering of drugs for crystal forms suitable for developing tablet formulations.
Original language | English (US) |
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Title of host publication | 2020 Virtual AIChE Annual Meeting |
Publisher | American Institute of Chemical Engineers |
Pages | 4217-4223 |
Number of pages | 7 |
ISBN (Electronic) | 9780816911141 |
DOIs | |
State | Published - 2020 |
Event | 2020 AIChE Annual Meeting - Virtual, Online Duration: Nov 16 2020 → Nov 20 2020 |
Publication series
Name | AIChE Annual Meeting, Conference Proceedings |
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Volume | 2020-November |
Conference
Conference | 2020 AIChE Annual Meeting |
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City | Virtual, Online |
Period | 11/16/20 → 11/20/20 |
Bibliographical note
Publisher Copyright:© 2020 American Chemical Society