Harrity, J.P.A., Fricero, P., Bialy, L. et al. (2 more authors) (2020) Design and synthesis of novel pyrazole based heterotricycles and their derivatization via automated library synthesis. ChemMedChem, 15 (17). pp. 1634-1638. ISSN 1860-7179
Abstract
Small molecule heterocycles bearing orthogonal functionality have the potential to deliver diverse structural motifs that aid the drug discovery effort. This work highlights how a readily assembled N ‐hydroxyethyl pyrazole trifluoroborate offers rapid access to architecturally distinct 5‐6‐6 and 5‐7‐6 fused tricyclic compounds. This chemistry is not only amenable to single compound synthesis, but also to high throughput experimentation. It enables easy access to diverse compound arrays with varying physchem and ADME profiles by fully automated library synthesis. The combination of the high throughput experimentation with rapid testing of the compounds in an integrated physchem and ADME profiling workflow allows accelerated design of novel lead compounds in drug discovery projects.
Metadata
Item Type: | Article |
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Authors/Creators: |
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Copyright, Publisher and Additional Information: | © 2020 WILEY‐VCH Verlag GmbH & Co. KGaA, Weinheim. This is an author-produced version of a paper subsequently published in ChemMedChem. Uploaded in accordance with the publisher's self-archiving policy. |
Keywords: | pyrazoles; boron; compound libraries; physicochemical; ADME |
Dates: |
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Institution: | The University of Sheffield |
Academic Units: | The University of Sheffield > Faculty of Science (Sheffield) > Department of Chemistry (Sheffield) |
Funding Information: | Funder Grant number EUROPEAN COMMISSION - FP6/FP7 COSSHNET - 606734 |
Depositing User: | Symplectic Sheffield |
Date Deposited: | 27 May 2020 14:30 |
Last Modified: | 16 Nov 2021 15:58 |
Status: | Published |
Publisher: | Wiley |
Refereed: | Yes |
Identification Number: | 10.1002/cmdc.202000187 |
Related URLs: | |
Open Archives Initiative ID (OAI ID): | oai:eprints.whiterose.ac.uk:161226 |