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A pair of Inhibitors Up against the 3C-Like Proteases involving Swine Coronavirus and Cat Coronavirus.
These structural models provide insights into stability for different turns and twists corresponding to non-regular folds in protein hotspots. This journal is © The Royal Society of Chemistry 2019.Photodynamic therapy is considered as a promising treatment for cancer, but still faces several challenges. The hypoxic environment in solid tumors, imprecise tumor recognition and the lack of selectivity between normal and cancer cells extremely hinder the applications of photodynamic therapy in clinics. Moreover, the "always on" property of photosensitizers also increases the toxicity to normal tissues when exposed to light irradiation. In this study, a hypoxia-activated NIR photosensitizer ICy-N was synthesized and successfully applied for in vivo cancer treatment. ICy-N is in the inactivated state with low fluorescence whereas its NIR emission (λ em = 716 nm) was induced via reduction caused by nitroreductase at the tumor site. In addition, the reduced product ICy-OH was specially located in the mitochondria and demonstrated a high singlet oxygen production under 660 nm light irradiation, which efficiently induced cell apoptosis (IC50 = 0.63 μM). The in vivo studies carried out in Balb/c mice indicated that ICy-N was suitable for precise tumor hypoxia imaging and can work as an efficient photosensitizer for restraining tumor growth through the PDT process. This journal is © The Royal Society of Chemistry 2019.Effective conversion of solar energy into chemical energy by visible light represents a potential strategy for sustainable development. Among which, photocatalytic hydrogen evolution reaction (HER) with a relatively small activation energy (1.23 eV, around 1000 nm light irradiation) is especially attractive. In this work, well-distributed platinum nanoparticles (Pt-NPs) with a width of about 3 nm have been successfully immobilized into the confined coordination interspaces of 3.7 nm diameter, which are facilitated by early transition metal Hf(iv)-based clusters of a self-sensitized palladium porphyrin metal-organic framework. Under visible light irradiation, the resultant Pt@Pd-PCN-222(Hf) (which is also denoted as Pt@Pd-PMOF-2(Hf)) displays superb photocatalytic activity, achieving an unprecedented maximum H2 evolution rate of 22 674 μmol g-1 h-1 with a turn-over number (TON) of 4131.2 in 32 h and the highest turn-over frequency (TOF) of 482.5 h-1 based on Pt-NPs. learn more This photocatalyst can be recycled and reused for three successive runs without significant loss of catalytic activity. This effective strategy takes advantage of the synergetic effect between Pd-porphyrin photosensitizers and Pt-NP co-catalysts confined within nanoscale coordination interspaces incorporating hydrophilic Hf(iv)-oxo clusters. This journal is © The Royal Society of Chemistry 2019.A series of molybdenum pincer complexes has been shown for the first time to be active in the catalytic hydrogenation of amides. Among the tested catalysts, Mo-1a proved to be particularly well suited for the selective C-N hydrogenolysis of N-methylated formanilides. Notably, high chemoselectivity was observed in the presence of certain reducible groups including even other amides. The general catalytic performance as well as selectivity issues could be rationalized taking an anionic Mo(0) as the active species. The interplay between the amide C[double bond, length as m-dash]O reduction and the catalyst poisoning by primary amides accounts for the selective hydrogenation of N-methylated formanilides. The catalyst resting state was found to be a Mo-alkoxo complex formed by reaction with the alcohol product. This species plays two opposed roles - it facilitates the protolytic cleavage of the C-N bond but it encumbers the activation of hydrogen. This journal is © The Royal Society of Chemistry 2019.A 1  1 Pd  ligand complex, [t-BuXPhos(Pd-π-cinnamyl)]OTf, has been identified as a highly robust pre-catalyst for amination reactions leading to diarylamines, where loadings of metal are typically at 1000 ppm Pd, run in water at temperatures between rt and 45 °C. The protocol is exceptionally simple, is readily scaled, and compares very favorably vs. traditional amination conditions. It has also been shown to successfully lead to key intermediates associated with several physiologically active compounds. This journal is © The Royal Society of Chemistry 2019.Blue light-emitting hybrid perovskite nanocrystals (NCs) are promising candidates for optoelectronic applications. However, these NCs suffer severely from low photoluminescence quantum yield (PLQY) and inferior stability under working conditions. Herein, we report, for the first time, a simultaneous dramatic improvement in both the luminescence and the stability of hybrid perovskite NCs through embedding in a porous metal-organic gel (MOG) matrix. The nanocomposite (EAPbBr3@MOG, EA ethylammonium) shows sharp emission in the intense blue region (λ max less then 440 nm), with a substantial ten-fold enhancement in the PLQY (∼53%) compared with EAPbBr3 NCs (PLQY ∼5%). Incorporation of perovskite NCs into the soft MOG matrix provides the additional benefits of flexibility as well as water stability. As a proof of principle, these nanocomposites were further utilized to fabricate a white light-emitting diode. The combination of high brightness, stability and flexibility of these nanocomposites could render them viable contenders in the development of efficient, blue light-emitting diodes for practical applications. This journal is © The Royal Society of Chemistry 2019.Electrophilic trifluoromethylation is at the forefront of methodologies available for the installation of the CF3 moiety to organic molecules; research in this field is largely spurred by the availability of stable and accessible trifluoromethylation reagents, of which hypervalent iodine and sulfoximine based compounds have emerged as two prominent reagent classes. Herein, we describe the facile synthesis of an electrophilic trifluoromethylation reagent which merges these two scaffolds in a novel hypervalent iodosulfoximine compound. This presents the first analogue of the well-known Togni reagents which neither compromises stability or reactivity. The electronic and physical properties of this new compound were fully explored by X-ray crystallography, cyclic voltammetry, TGA/DSC and DFT analysis. This solution stable, crystalline reagent was found to be competent in the electrophilic trifluoromethylation of a variety of nucleophiles as well as a source of the trifluoromethyl radical. Furthermore, the possibility of enantioinductive transformations could be probed with the isolation of the first enantiopure hypervalent iodine compound bearing a CF3 group, thus this new reagent scaffold offers the opportunity of structurally diversifying the reagent towards asymmetric synthesis.
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