Flow chemistry in drug discovery / Jesus Alcazar, Antonio de la Hoz, Angel Díaz-Ortiz, editors ; with contributions by I. Abdiaj [and 30 others]
This book reviews the challenges and opportunities posed by flow chemistry in drug discovery, and offers a handy reference tool for medicinal chemists interested in the synthesis of biologically active compounds. Prepared by expert contributors, the respective chapters cover not only fundamental met...
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Other Authors: | , , |
Format: | eBook |
Language: | English |
Published: |
Cham :
Springer,
[2021]
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Series: | Topics in medicinal chemistry (Springer (Firm)) ;
v. 38. |
Subjects: |
Table of Contents:
- Intro
- Preface
- Contents
- List of Abbreviations
- Flow Chemistry in Drug Discovery: Challenges and Opportunities
- 1 Introduction
- 1.1 Introduction to Flow Chemistry
- 1.2 Flow Chemistry Setup
- 1.3 Types of Transformations
- 2 The Drug Discovery Process in Pharma
- 3 Flow Chemistry as a Tool to Improve Drug Discovery
- 3.1 Green Components of Flow Chemistry
- 3.2 Diversity Oriented Synthesis (DOS) in Flow
- 3.3 Catalysis in Flow
- 3.3.1 Hetero- and Homogeneous Catalysis
- 3.3.2 Biocatalysis
- 3.3.3 Photocatalysis
- 3.4 Electrochemistry in Flow.
- 3.5 Library Synthesis and Automation Using Flow
- 3.6 Artificial Intelligence (AI) and Flow Chemistry
- 4 Conclusions and Outlook
- References
- Green Aspects of Flow Chemistry for Drug Discovery
- 1 Introduction
- 2 Solvents
- 2.1 Supercritical Fluids and Ionic Liquids
- 2.2 Deep Eutectic Solvents
- 2.3 Biomass-Derived Solvents
- 2.4 Miscellaneous
- 3 Enabling Technologies
- 3.1 Photochemistry
- 3.2 Electrochemistry
- 3.3 Biocatalysis
- 3.4 Microwaves
- 4 Hazardous Reagents
- 4.1 Azides
- 4.2 Diazomethane
- 4.3 Hydrogenation
- 4.4 Carbonylation
- 4.5 Miscellaneous.
- 5 Monitoring, Optimization, and Scale-Up in the Pharmaceutical Industry
- 5.1 Monitoring
- 5.2 Automatization
- 5.3 3D Printing
- 5.4 Optimization
- 5.5 Process Intensification and Scale-Up
- 6 Quantification of Sustainability (LCA)
- 7 Conclusions
- References
- Photochemistry in Flow for Drug Discovery
- 1 Introduction
- 2 Carbon-Carbon and Carbon-Heteroatom Bond Formation
- 2.1 Diazonium Salts and Diazo Compounds for C-C and C-X Bond Formation
- 2.2 Photoinduced Metal- and Dye-Catalysed C-C and C-X Bond Formation
- 2.3 C-C Bond Formation via Photodecarboxylation.
- 3 Photochemical Cyclization Reactions
- 4 Photochemical Rearrangement Reactions
- 5 Incorporation of Fluorine and Fluorine-Containing Groups
- 6 Trend to Photochemical-Assisted Biocatalysis
- 7 Summary
- References
- Electrochemistry in Flow for Drug Discovery
- 1 Introduction
- 1.1 General Introduction
- 1.2 Introduction to Electrochemistry
- 1.3 Fundamentals of Organic Electrochemistry
- 1.4 Methods for Organic Electrosynthesis
- 1.4.1 Controlled Potential Electrolysis (Potentiostatic)
- 1.4.2 Constant Current Electrolysis (Galvanostatic)
- 1.5 Cyclic Voltammetry.
- 1.6 Direct vs Indirect Electrolysis
- 1.7 Types of Cells
- 1.7.1 Batch Cells
- 1.7.2 Flow Electrochemical Reactors
- Parallel Plate Flow Cells
- Thin-Layer Flow Cells
- Porous Flow Cells
- Automated Flow Electrolysis Platforms
- 2 Flow Electrochemistry for Drug Discovery
- 2.1 Flow Electrosynthesis of Pharmaceutically Relevant Scaffolds/Fragments
- 2.1.1 Electrochemical Synthesis of Nitrile-Containing Scaffolds
- 2.1.2 Electrochemical Synthesis of Benzoxazoles and Benzothiazoles
- 2.1.3 Electrosynthesis of N-Containing Heterocycles by Nitrogen-Centred Radicals.