Acid-Promoted Oxygen-Atom Transfer from a Novel Dihydroisoquinoline-Derived Oxaziridine Substituted at Position 1

N-Alkyl-oxaziridines react in the presence of a nucleophile as an oxygenating agent; in the absence of a nucleophile, an isomerization reaction is observed. This study describes the synthesis of two new dihydroisoquinoline oxaziridines and their reactivity in an acid-promoted reaction in the presence and absence of sulfides.     

Phytochemical and In Silico ADME/Tox Analysis of Eruca sativa Extract with Antioxidant,Antibacterial and Anticancer Potential against Caco-2 and HCT-116 Colorectal Carcinoma Cell Lines

Eruca sativa Mill. (E. sativa) leaves recently grabbed the attention of scientific communities around the world due to its potent bioactivity. Therefore, the present study investigates the metabolite profiling of the ethanolic crude extract of E. sativa leaves using high resolution-liquid chromatography-mass spectrometry (HR-LC/MS), including antibacterial, antioxidant and anticancer potential against human colorectal carcinoma cell lines. In addition, computer-aided analysis was performed for determining the pharmacokinetic properties and toxicity prediction of the identified compounds. Our results show that E. sativa contains several bioactive compounds, such as vitamins, fatty acids, alkaloids, flavonoids, terpenoids and phenols. Furthermore, the antibacterial assay of E. sativa extract showed inhibitory effects of the tested pathogenic bacterial strains. Moreover, the antioxidant activity of 2,2-diphenyl-1-picrylhydrazyl (DPPH) and hydrogen peroxide (H₂O₂) were found to be IC₅₀ = 66.16 μg/mL and 76.05 μg/mL, respectively. E. sativa also showed promising anticancer activity against both the colorectal cancer cells HCT-116 (IC₅₀ = 64.91 μg/mL) and Caco-2 (IC₅₀ = 83.98 μg/mL) in a dose/time dependent manner. The phytoconstituents identified showed promising pharmacokinetics properties, representing a valuable source for drug or nutraceutical development. These investigations will lead to the further exploration as well as development of E. sativa-based nutraceutical products.     

Facile and Convenient Synthesis of 1‐Perfluoroalkyl‐1,2,4‐triazoles

Treatment of N‐methylcarbonyl 1, N‐phenylthioamido 2, and N‐cyano 3 iminoethers with perfluoroalkylated hydrazines leads to 1‐perfluoroalkyl‐5‐methyl‐1,2,4‐ triazoles, 4,1‐perfluoroalkyl‐5‐phenylamino‐1,2,4‐triazoles 5, and 1‐perfluoroalkyl‐5‐amino‐1,2,4‐triazoles 6 in good yields. These compounds are screened for their biological activities.     

Vibro-acoustic response of orthogonally stiffened panels: The effects of finite dimensions

This paper investigates the effects of finite dimensions on the vibro-acoustic response of orthogonally stiffened panels. Three types of excitations are considered: acoustical excitation, point force excitation and random excitation by a turbulent boundary layer. In each case, a spatially windowed periodic model is compared with a Rayleigh-Ritz model where the modes of the un-stiffened panel are used as the basis functions. The latter model accounts for the reflected wave field generated at the boundaries by assuming that the panel is simply supported. On the contrary, the windowed periodic model only accounts for finiteness on sound radiation (the assumption of an infinite periodic structure is used to calculate the panel response). Numerical studies show that when the bending wavelength becomes comparable or smaller than the stiffener spacing, the periodic model is able to reproduce the results obtained with the Rayleigh-Ritz model. To complement the study, the developed models are compared with numerical simulations (finite element method) and with experimental results.     

Genetic diversity and haplotype structure of 21 Y‐STRs,including nine noncore loci,in South Tunisian Population: Forensic relevance

Y chromosome STRs (Y‐STRs) are being used frequently in forensic laboratories. Previous studies of Y‐STR polymorphisms in different groups of the Tunisian population identified low levels of diversity and discrimination capacity (DC) using various commercial marker sets. This definitely limits the use of such systems for Y‐STRs genotyping in Tunisia. In our investigation on South Tunisia, 200 unrelated males were typed for the 12 conventional Y‐STRs included in the PowerPlex® Y System. Additional set of nine noncore Y‐STRs including DYS446, DYS456, DYS458, DYS388, DYS444, DYS445, DYS449, DYS710, and DYS464 markers were genotyped and evaluated for their potential in improving DC. Allele frequency, gene diversity, haplotype diversity (HD), and DC calculation revealed that DYS464 was the most diverse marker followed by DYS710 and DYS449 markers. The standard panel of 12 Y‐STRs (DC = 80.5%) and the nine markers were combined to obtain DC of 99%. Among the 198 different haplotypes observed, 196 haplotypes were unique (HD = 99.999). Out of the nine noncore set, six Y‐STRs (DYS458, DYS456, DYS449, DYS710, DYS444, and DYS464) had the greatest impact on enhancing DC. Our data provided putative Y‐STRs combination to be used for genetic and forensic applications.     

Un nouveau préconditionneur pour les problèmes elliptiques à coefficients variablesA new preconditonner for general elleptic problems

In this Note we describe a preconditionner for iteratively solving the linear system arising from the discretization of a general nonseparable elliptic problem by spectral element method. This preconditionner is constructed from approximating the original problem with the closest (in some sense) separable elliptic problem. A direct method is then used to invert the preconditionner. To cite this article: M. Azaïez et al., C. R. Mecanique 331 (2003).     

Spectral discretization of Darcy’s equations with pressure dependent porosity

We consider the flow of a viscous incompressible fluid in a rigid homogeneous porous medium provided with boundary conditions on the pressure around a circular well. When the boundary pressure presents high variations, the permeability of the medium depends on the pressure, so that the model is nonlinear. We propose a spectral discretization of the resulting system of equations which takes into account the axisymmetry of the domain and of the flow. We prove optimal error estimates and present some numerical experiments which confirm the interest of the discretization.     

Nanoscale flexoelectric energy harvesting

One of the most tantalizing applications of piezoelectricity is to harvest energy from ambient mechanical vibrations for powering micro and nano devices. However, piezoelectricity is restricted only to certain materials and is severely compromised at high temperatures. In this article, we examine in detail, the possibility of using the phenomenon of flexoelectricity for energy harvesting. The flexoelectric effect is universally present in all dielectrics and exhibits a strong scaling with size. Using a simple beam-based paradigmatical design, we theoretically and computationally examine flexoelectric energy harvesting under harmonic mechanical excitation. We find that the output power density and conversion efficiency increase significantly when the beam thickness reduces from micro to nanoscale and flexoelectricity-based energy harvesting can be a viable alternative to piezoelectrics. Specifically, the conversion efficiency in flexoelectric transduction at sub-micron thickness levels is observed to increase by two orders of magnitude as the thickness is reduced by an order of magnitude. The flexoelectric energy harvester works even for a single layer beam with a symmetric cross section which is not possible in piezoelectric energy harvesting. Our results also pave the way for exploration of high temperature energy harvesting since unlike piezoelectricity, flexoelectricity persists well beyond the Curie temperatures of the high electromechanical coupling ferroelectrics that are often used.