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Design and Synthesis of Fused Pyridine Building Blocks for Automated Library Generation
Author(s) -
MoraRadó Helena,
Czechtizky Werngard,
Méndez María,
Harrity Joseph P. A.
Publication year - 2021
Publication title -
chemmedchem
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.817
H-Index - 100
eISSN - 1860-7187
pISSN - 1860-7179
DOI - 10.1002/cmdc.202000852
Subject(s) - adme , pyridine , workflow , drug discovery , combinatorial chemistry , computer science , chemistry , computer architecture , nanotechnology , organic chemistry , database , materials science , in vitro , biochemistry
We demonstrate that a diboration‐electrocyclization sequence provides access to a range of pyridine‐fused, small‐molecule boronic ester building blocks, and that these are amenable to high‐throughput synthesis leading to biaryl and ether‐linked compound libraries. Moreover, the implementation of an integrated physicochemical and ADME profiling workflow allows accelerated design of novel lead compounds for application in drug‐discovery projects.