Synthesis and Characterization of Antimony(III) Complexes of Thioamides,and Crystal Structure of {[Sb(Imt)2Cl2]2((2‐Imt)}Cl2(Imt=Imidazolidine‐2‐thione)

Antimony(III) complexes of thioamides [thioamides=thiourea (Tu), N,N′‐dimethylthiourea (Dmtu), tetramethylthiourea (Tmtu), imidazolidine‐2‐thione (Imt) and diazinane‐2‐thione (Diaz)] with the general formulae, Sb(thione)_nCl₃ (n=1, 2, 2.5, 3) were prepared and characterized by elemental analysis, IR and NMR (¹H, ¹³C) spectroscopic methods. The spectral data of the complexes are consistent with the coordination of the thiones to antimony(III). The crystal structure of one of them, {[Sb(Imt)₂Cl₂]₂(μ₂‐Imt)}Cl₂ ( 1 ), was determined by X‐ray crystallography, which shows that the complex is dinuclear consisting of two [Sb(Imt)₂Cl₂] units bridged by an Imt molecule. In 1 , the antimony atom is bonded to two chlorine atoms, two sulfur atoms of coordinated Imt molecules and one sulfur atom of a bridging Imt molecule. The antimony environment can be considered to be distorted octahedral with one Cl^? ion weakly bound to antimony.     

Synthesis of new chiral heterocyclic Schiff base modulated Cu(II)/Zn(II) complexes: their comparative binding studies with CT-DNA, mononucleotides and cleavage activity

New Schiff base ligand L derived from the condensation reaction of 2-amino-3-formylchromone with (R)-2-amino-2-phenylethanol was synthesized and characterized which involves combination element of ammine functionality and naturally occurring heterocyclic chromone, 4H-benzopyran-4-one. Subsequently, their complexes 1 and 2 with Cu(NO?)? and Zn(NO?)?, respectively were prepared. The DNA binding studies of the ligand L and complexes 1 and 2 with CT-DNA as compared to classical anticancer drug cisplatin were carried out by employing different optical methods viz, UV-vis, fluorescence, circular dichroism and viscosity measurements. Furthermore, the absorption studies, 1H and 31P with mononucleotides were also monitored to examine the base specific interactions of the transition metal complexes which revealed a higher propensity of copper(II) complex 1 for 5'-GMP while for zinc(II) complex 2 towards 5'-TMP involving groove binding mechanism of the complexes towards DNA. The complex 1 exhibits a remarkable DNA cleavage activity with pBR322 DNA in presence of different activators and cleavage reaction involves various oxygen species suggesting the involvement of active oxygen species for the DNA scission.     

Structure and dynamics of highly PEG-ylated sterically stabilized micelles in aqueous media

Molecular assemblies of highly PEG-ylated phospholipids are important in many biomedical applications. We have studied sterically stabilized micelles (SSMs) of self-assembled DSPE–PEG2000 in pure water and isotonic HEPES-buffered saline solution. The observed SSM sizes of 2–15 nm largely depend on the solvent and the lipid concentration used. The critical micelle concentration of DSPE–PEG2000 is 10 times higher in water than in buffer, and the viscosity of the dispersion dramatically increases with the lipid concentration. To explain the experimentally observed results, we performed atomistic molecular dynamics simulations of solvated SSMs. Our modeling revealed that the observed assemblies have very different aggregation numbers (N(agg) ≈ 90 in saline solution and N(agg) < 8 in water) because of very different screening of their charged PO4(–) groups. We also demonstrate that the micelle cores can inflate and their coronas can fluctuate strongly, thus allowing storage and delivery of molecules with different chemistries.     

Caragisides A – C,New Isoflavone Glucosides from Caragana conferta with Inhibition of Platelet Aggregation

Caragisides A–C ( 1 – 3 , resp.), three new isoflavone glucosides, were isolated from the BuOH sub‐fraction of the EtOH extract of the whole plant of Caragana conferta, along with ononoside ( 4 ), reported for the first time from this species. The structures of the new compounds were elucidated by spectroscopic techniques including MS and 2D‐NMR spectroscopy. Compounds 1 – 3 showed significant inhibition of platelet aggregation.     

Carrageenan as an elicitor of induced secondary metabolites and its effects on various growth characters of chickpea and maize plants

The effects of polysaccharide elicitor k-carrageenan obtained from Hypnea musciformis, red algae on the production of Induced Secondary Metabolites, ISMs (the disease resistance compounds) and on various growth characters of chickpea and maize plants were studied. Experiments were conducted in the field of PCSIR Laboratories Complex Karachi during December 2008–April 2009 in randomized complete block design with three replications. Three elicitor treatments were used, a solid preparation in which the elicitor was mixed with soil (T₂ 1 mg/g) and applied around the seeds in the soil. The two other preparations were liquid, T₁ and T₃ at a concentration of 100 μg glc eq ml⁻¹ and were applied around the sowing seeds and as a foliar spray on the plants, respectively. Statistical analysis of the data revealed that these treatments significantly enhanced all the growth characters of chickpea except T₂ that gave the nonsignificant difference in the plant height. Maximum plant height (80.3 cm), number of pods plant⁻¹ (76.2), number of branches plant⁻¹ (25.0), number of leaves plant⁻¹ (125.6), earlier flowering and high ISMs contents in leaves, stem and grains of chickpea were recorded in T₁ treated chickpea plants. In maize plants only T₁ and T₃ treatments (with minor exceptions) had significant effects on few characters like plant height, stem diameter, number of leaves plant⁻¹ and on ISMs contents in leaves while number of cobs plant⁻¹ and flowering time were nonsignificantly affected by these treatments. These results suggested that k-carrageenan elicitor can be used as a potent plant protectant as well as growth promoting agent especially for chickpea plants.     

Synthesis, physical studies and uptake behavior of: copper(II) and lead(II) by Schiff base chelating resins

Two new chelating resins possessing multiple functional groups capable of coordinating with several metal ions are reported. The resins were synthesized by condensing Schiff bases derived from 2-aminophenol, 2-hydroxy-5-chloroaniline and terephthaldehyde with formaldehyde in an alkaline medium. The effects of pH and contact time of the Cu(2+) and Pb(2+) in aqueous solutions on the uptake behavior of the resins were studied. The metal ion uptake behavior of the resins was investigated by the batch method. Both the uptake and the selectivity of the resins towards the investigated metal ions were related to the structure of the resins, type of the metal ion and the uptake conditions. The resins showed maximum uptake capacity for Cu(2+) and Pb(2+) at pH 10. Cu(2+) was seen to undergo preferential adsorption in separate and mixture solutions of Cu(2+) and Pb(2+). Kinetic studies for the resins using Langmiur equation were also performed. The Schiff base monomers and their formaldehyde resins were characterized by elemental analyses, FTIR and (1)H NMR spectroscopy. The thermal stability of the resins was studied using TGA/DTG analysis.     

Effect of partial immunity on transmission dynamics of dengue disease with optimal control

Dengue fever is one of the most dangerous vector‐borne diseases in the world in terms of death and economic cost. Hence, the modeling of dengue fever is of great significance to understand the dynamics of dengue. In this paper, we extend dengue disease transmission models by including transmit vaccinated class, in which a portion of recovered individual loses immunity and moves to the susceptibles with limited immunity and hence a less transmission probability. We obtain the threshold dynamics governed by the basic reproduction number R₀; it is shown that the disease‐free equilibrium is locally asymptotically stable if R₀ ≤ 1, and the system is uniformly persistence if R₀ > 1. We do sensitivity analysis in order to identify the key factors that greatly affect the dengue infection, and the partial rank correlation coefficient (PRCC) values for R₀ shows that the bitting rate is the most effective in lowering dengue new infections, and moreover, control of mosquito size plays an essential role in reducing equilibrium level of dengue infection. Hence, the public are highly suggested to control population size of mosquitoes and to use mosquito nets. By formulating the control objective, associated with the low infection and costs, we propose an optimal control question. By the application of optimal control theory, we analyze the existence of optimal control and obtain necessary conditions for optimal controls. Numerical simulations are carried out to show the effectiveness of control strategies; these simulations recommended that control measures such as protection from mosquito bites and mosquito eradication strategies effectively control and eradicate the dengue infections during the whole epidemic.     

Synthesis of novel 2,3-substituted quinazolin-4-ones by condensation of alkyl or aromatic diamines with 5-(N-arylimino)-4-chloro-5H-1,2,3-dithiazoles

The work described in this paper is a further example of the utility of Appel's salt in the conception of novel heterocyclic rings. We confirmed that primary alkyldiamines may react easily with the methyl N-(4-chloro-5H-1,2,3-dithiazol-5-ylidene)-anthranilates to afford quinazolines, which are very interesting starting materials for the access to novel 2,3-condensed quinazolin-4-ones. On the other side, aromatic amines allow the synthesis of polycyclic molecules, which are structurally close to the model natural products (e.g., rutaecarpine, luotonine, tryptanthrine and vasicinone).     

On electromagnetic properties of rotating nuclei in crpa

An analysis of quasiparticle correlations with special emphasis on transition matrix elements have been done for a self-consistent cranking model. It is pointed out that a second order of the boson representation of a transition operator leads to a signature dependence of transition probabilities between excited one-phonon states in even-even nuclei. Moreover, it brings about the new contribution to an expectation value of electromagnetic moments in the yrast line states of deformed nuclei.     

Cation thin-layer chromatography in mixed organic solvents containing s-butylamine: Separation of Zn(II) from Cd(II) and Cu(II)

Summary A TLC method has been developed for the separation of Zn(II) from Cd(II) and Cu(II) on silica gel alyers with mixed organic solvents containing s-butylamine. The separation of Zn(II) from Cd(II) in the presence of certain anions and at various pH values of sample solution was examined. A mixture containign s-butylamine, acetone and formic acid in 262 was found to be the best solvent.