Synonyms: Aryl Halide Chemistry Informer Library Compound X3
Molecular Formula: C18H16BrNO5S
Molecular Weight: 438.29
Linear Structural Formula: C18H16BrNO5S
Melting Point: 189-194 C
Application: This product is Informer compound X3 of the Aryl Halide Chemistry Informer Library developed by chemists at Merck & Co., Inc., Kenilworth, NJ, U.S., which contains 18 drug-like molecules representative of those encountered in complex synthesis. By screening a new reaction against the Informer Library, chemists can directly compare and analyse a reaction's successes and shortcomings among different methods and various research teams. It may also be used to facilitate deeper method development for performance or utility.
Other Notes: 1.Chemistry informer libraries: a chemoinformatics enabled approach to evaluate and advance synthetic methods, Chem. Sci., 2016, 7, 2604-2613.2.Synthesis of Complex Druglike Molecules by the Use of Highly Functionalized Bench-Stable Organozinc Reagents3.Aryl amination using ligand-free Ni(II) salts and photoredox catalysis.