Stereoselectivity Predictions for the Pd-Catalyzed 1,4-Conjugate Addition Using Quantum-Guided Molecular Mechanics-Reference-Cited by-同舟云学术

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Stereoselectivity Predictions for the Pd-Catalyzed 1,4-Conjugate Addition Using Quantum-Guided Molecular Mechanics

Published:2021-03-26 Issue:8 Volume:86 Page:5660-5667
ISSN:0022-3263
Container-title:The Journal of Organic Chemistry
language:en
Short-container-title:J. Org. Chem.

Author:

Wahlers Jessica¹,Maloney Michael¹,Salahi Farbod¹,Rosales Anthony R.¹^ORCID,Helquist Paul¹^ORCID,Norrby Per-Ola²³^ORCID,Wiest Olaf¹^ORCID

Affiliation:

1. Department of Chemistry and Biochemistry, University of Notre Dame, Notre Dame, Indiana 46556, United States

2. Data Science and Modelling, Pharmaceutical Sciences, R&D, AstraZeneca Gothenburg, Pepparedsleden 1, SE-431 83 Mölndal, Sweden

3. Department of Chemistry and Molecular Biology, University of Gothenburg, SE-412 96 Gothenburg, Sweden

Funder

Division of Chemistry

National Institute of General Medical Sciences

Publisher

American Chemical Society (ACS)

Subject

Organic Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.joc.1c00136

Reference46 articles.

1. Stepwise Palladium-Catalyzed 1,4-Addition of Arylboronic Acids to Enones and Regioselective Baeyer–Villiger Oxidation for Enantioselective Synthesis of β-Diaryl Esters and (+)-(R)-Tolterodine

2. Creation of Quaternary Stereogenic Centers via Copper-Catalyzed Asymmetric Conjugate Addition of Alkenyl Alanes to α,β-Unsaturated Cyclic Ketones

3. Synthesis of diverse β-quaternary ketones via palladium-catalyzed asymmetric conjugate addition of arylboronic acids to cyclic enones

4. Recent Advances in Metal-Catalyzed Asymmetric 1,4-Conjugate Addition (ACA) of Nonorganometallic Nucleophiles

5. Catalytic Enantioselective Construction of Quaternary Stereocenters: Assembly of Key Building Blocks for the Synthesis of Biologically Active Molecules

Cited by 5 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. Interplay of Computation and Experiment in Enantioselective Catalysis: Rationalization, Prediction, and─Correction?;ACS Catalysis;2023-10-26

2. Study of Pd-catalyzed Selective Mono- and Di-C(sp³)–H Bond Activation: A Bi-ligand Model;The Journal of Organic Chemistry;2022-07-28

3. Automated fitting of transition state force fields for biomolecular simulations;PLOS ONE;2022-03-10

4. Importance of favourable non-covalent contacts in the stereoselective synthesis of tetrasubstituted chromanones;Organic Chemistry Frontiers;2022

5. Recent advances in palladium-catalysed asymmetric 1,4–additions of arylboronic acids to conjugated enones and chromones;Beilstein Journal of Organic Chemistry;2021-05-10

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