787-69-9Relevant articles and documents
Effects of P-glycoprotein on the transport of DL0410, a potential multifunctional anti-Alzheimer agent
Pang, Xiaocong,Wang, Lin,Kang, De,Zhao, Ying,Wu, Song,Liu, Ai-Lin,Du, Guan-Hua
, (2017)
In our study, we attempted to investigate the influences of P-glycoprotein (P-gp) on DL0410, a novel synthetic molecule for Alzheimer’s disease (AD) treatment, for intestinal absorption and blood-brain barrier permeability in vitro and related binding mechanisms in silico. Caco-2, MDCK, and MDCK-MDR1 cells were utilized for transport studies, and homology modelling of human P-gp was built for further docking study to uncover the binding mode of DL0410. The results showed that the apparent permeability (Papp) value of DL0410 was approximately 1 × 10?6 cm/s, indicating the low permeability of DL0410. With the presence of verapamil, the directional transport of DL0410 disappeared in Caco-2 and MDCK-MDR1 cells, suggesting that DL0410 should be a substrate of P-gp, which was also confirmed by P-gp ATPase assay. In addition, DL0410 could competitively inhibit the transport of Rho123, a P-gp known substrate. According to molecular docking, we also found that DL0410 could bind to the drug binding pocket (DBP), but not the nucleotide binding domain (NBD). In conclusion, DL0410 was a substrate as well as a competitive inhibitor of P-gp, and P-gp had a remarkable impact on the intestine and brain permeability of DL0410, which is of significance for drug research and development.
A series of triple-stranded lanthanide(III) helicates: Syntheses, structures and single molecular magnets
Gao, Xingrui,Li, Hongfeng,Chen, Peng,Sun, Wenbin,Yan, Pengfei
, p. 1 - 7 (2017)
Bis-β-diketones have been proven to be effective for the construction of multiple-stranded helicates, where there commonly are two distinct Ln3+centers with subtle geometric difference. In this study, a series of triple-stranded helicates [Ln2(BTB)3(DME)2]·C6H14have been prepared with the ligand H2BTB and trivalent metallic ions, respectively [Ln?=?La (1), Ce (2), Pr (3), Eu (4), Dy (5), Ho (6) and Yb (7), H2BTB?=?4,4′-bis(4,4,4-trifluoro-1,3-dioxobutyl)biphenyl and DME?=?dimethoxyethane]. All products have been fully characterized by IR spectroscopy, elemental analysis, thermogravimetric analysis, and single-crystal X-ray diffraction analyses. Structural analysis reveals that 1–7 are isostructurally crystallized in the orthorhombic space group of Pna21and each Ln3+ion is ligated to six O atoms of three BTB ligands and two O atoms of one DME molecule. Interestingly, DME molecule as a chelator to the Ln3+centers has played a unique role in the crystallization of the triple-stranded helicate 1–7. Magnetic measurement shows that 5 displays significant single-molecule magnetic property, exhibiting magnetic slow relaxation. And the large separation between Dy3+ions in the same helicates leads to two distinct magnetic relaxation processes.
An imidazolium ionic liquid having covalently attached an oxime carbapalladacycle complex as ionophilic heterogeneous catalysts for the Heck and Suzuki-Miyaura cross-coupling
Corma, Avelino,García, Hermenegildo,Leyva, Antonio
, p. 8553 - 8560 (2004)
An oxime carbapalladacycle, analogous to that used as catalyst in homogeneous phase, has been derivatized to increase its ionophilicity by introducing an imidazolium group covalently attached through a chain at the complex. The resulting complex is soluble in 1-butyl-3-methylimidazolium ionic liquid (bmimPF6) and not extractable by ether. The catalytic activity of this palladium complex in bmimPF6 is, however, unsatisfactory and only increases marginally in bmimPF6/supercritical CO2. This limitation has been overcome by supporting this imidazolium palladium complex on high surface area Al/MCM-41 aluminosilicate, whereby a solid active catalyst for the Suzuki cross-coupling has been obtained. Reusability and stability over reuse for this Al/MCM-41-supported catalyst have been studied. Graphical abstract.
Ultrafine and Highly Dispersed Pd/SiO2 for Suzuki?Miyaura Cross-coupling Reactions
Fan, Xizheng,Yang, Jingyi,Pang, Qingqing,Liu, Zhongyi,Zhang, Panke,Yang, Jing-He
, p. 2291 - 2301 (2021/01/04)
Abstract: Construction of heterogeneous Pd/SiO2 catalyst via the pollution-free strategy marked strong electrostatic adsorption has been reported for the application to Suzuki–Miyaura cross-coupling reactions. The exposed negatively charged oxygen groups, which were converted from the hydroxyl groups on the surface of silica under the alkaline atmosphere, could effectively anchor palladium species to form ultrafine Pd nanoparticles (Pd NPs) with an average particle size of 1.3?nm and high dispersion (43%). Pd/SiO2 catalyst was endowed with the excellent catalytic performance which was that the yield of the Suzuki–Miyaura reaction between bromobenzene and phenylboronic acid at 40?°C was > 99% for 30?min and the TOF was ~ 80,000?h?1. The catalyst could be easily recovered and recycled by facile procedure without a significant decrease in catalytic activity, which was able to maintain the 90% yield after repeated for 8 times. In addition, a continuous flow reaction device was designed using the Pd/SiO2 catalyst to effectively improve the production efficiency of biphenyl. Graphic Abstract: Pd/SiO2 catalyst constructed with the strategy of strong electrostatic adsorption (SEA) possesses uniformly dispersed and highly exposed Pd sites which can be easily transformed into electron-deficient Pdδ+ and strengthened stability for itself due to its strong interaction with the front surface of the carrier, and has been endowed the outstanding catalytic performance for Suzuki?Miyaura cross-coupling reaction. [Figure not available: see fulltext.]
Electrochemical coupling halobenzene into biphenyl on a reusable Pd nanoparticle-coated carbon-paper electrode at ambient conditions
Wang, Chao-Nan,Lu, Yong-Heng,Liu, Yue,Liu, Jun,Yang, Yao-Yue,Zhao, Zhi-Gang
, p. 3997 - 4003 (2021/03/06)
Electrochemical organic synthesis (EOS) employing electrons to directly activate the reactants can readily complete the chemical conversion under mild conditions. Here, it presented an efficient electrochemical coupling halobenzene into biphenyl on a Pd nanoparticle-coated cathode. The biphenyl product can be obtained with a yield up to 77% at 35 mA, 6 h (3.9 F mol?1). In addition, after consecutive fifth run of the coupling reaction, the yield still remained atca.40%, suggesting its considerable recyclable capacity. In addition, the preliminary kinetics studyviathe off-line gas chromatography analysis of the reaction mixture shows a two-section reaction process, including the introduction process (IP) and fast conversion process (FCP). Further, the estimated reaction kinetics constant value of 0.196 min?1for FCP suggests a more effective conversion than that obtained by the previous study. This study adopts a simple way to fabricate a low-cost and reusable Pd electrode, achieving a high-efficiency electrochemical strategy for the Ullmann-type coupling reaction at mild conditions, and holds a great promise to extend this synthesis route to other important organic synthesis.