Search results for "HILIC"

showing 10 items of 745 documents

ChemInform Abstract: Thioetherification of Chloroheteroarenes: A Binuclear Catalyst Promotes Wide Scope and High Functional-Group Tolerance.

2015

The nucleophilic substitution of a variety of chloro- and bromohetarenes with arylthiols is optimized to use [PdCl(allyl)]2 in combination with a ferrocenyltetraphosphane as ligand.

chemistry.chemical_compoundScope (project management)LigandChemistryFunctional groupNucleophilic substitutionGeneral MedicineCombinatorial chemistryCatalysisChemInform
researchProduct

ChemInform Abstract: Unique Regioselectivity in the C(sp3)-H α-Alkylation of Amines: The Benzoxazole Moiety as a Removable Directing Group.

2015

The benzoxazol-2-yl substituent is easily introduced by oxidative coupling or nucleophilic substitution and can be removed by hydroxide or by hydride reduction.

chemistry.chemical_compoundchemistryHydrideSubstituentNucleophilic substitutionRegioselectivityHydroxideMoietyGeneral MedicineAlkylationBenzoxazoleMedicinal chemistryChemInform
researchProduct

Synthese und biochemische Eigenschaften substituierter Phenoxy- und Anilino-1,3,5-triazine

1983

Die nucleophile Substitution eines Chloratoms in 2,4-Dichlor-6-diethylamino-1,3,5-triazin (1) durch die Hydroxyacetophenone 2a–c fuhrt zu den 2-Acetylphenoxy-4-chlor-6-diethylamino-1,3,5-triazinen 3a–c. Analog geht aus der Umsetzung von 1 mit 4-Fluoranilin (4a) das Monoanilinoderivat 5a hervor; dagegen bildet sich unter den gleichen Reaktionsbedingungen aus 1 und 2-Fluoranilin (4b) das Dianilinoderivat 5b. Strukturtyp 3 zeichnet sich durch antimykotische und Antiprotozoenwirksamkeit aus, wahrend 5 herbizide Wirkungen auszulosen vermag. Synthesis and Biochemical Properties of Substituted Phenoxy- and Anilino-1,3,5-triazines The nucleophilic substitution of one chlorine atom in 2,4-dichloro-6…

chemistry.chemical_compoundchemistryNucleophileDrug DiscoveryChlorine atomNucleophilic substitutionPharmaceutical ScienceMedicinal chemistryDerivative (chemistry)Archiv der Pharmazie
researchProduct

A new method for the regioselective synthesis of β-enamino acid derivatives

1993

Abstract A mild, simple and efficient route to β-enamino imidazole carbonilic derivatives 3 by reaction of ketimines with N,N′ -carbonyl diimidazole in the presence of boron triflouride as catalyst has been developed. The conversion of 3 to esters has also been explored.

chemistry.chemical_compoundchemistryOrganic ChemistryDrug DiscoveryNucleophilic substitutionImidazoleRegioselectivitychemistry.chemical_elementBoronBiochemistryCarbonylationCombinatorial chemistryCatalysisTetrahedron Letters
researchProduct

Cyclam-strapped porphyrins and their iron(III)-copper(II) complexes as models for the resting state of cytochrome c oxidase

1999

International audience; The ESR study of two cyclam-strapped porphyrins in which, on one side, the cyclam is attached with a variable length linker to the porphyrin and, on the other side, a non-coordinating strap protects the iron from any intermolecular interaction, is reported. Variation of the linker length is made possible by the use of either a Michael reaction or a nucleophilic substitution, leading respectively to three or two carbon atom links. It is shown that in the case of the shortest link, the oxidized ironÈcopper complex exhibits a spin interaction. The distance between thetwo metal centers is evaluated to be around 4.5 Å, a value consistent with the one found in the natural …

chemistry.chemical_element010402 general chemistryPhotochemistry01 natural sciences[ CHIM ] Chemical SciencesCatalysisMetalchemistry.chemical_compoundCyclam[CHIM] Chemical SciencesMaterials ChemistryNucleophilic substitutionCytochrome c oxidase[CHIM]Chemical Sciencesbiology010405 organic chemistryGeneral ChemistryPorphyrinCopper0104 chemical sciencesCrystallographychemistryvisual_artvisual_art.visual_art_mediumMichael reactionbiology.proteinLinker
researchProduct

Wykorzystanie dwuwymiarowej chromatografii cieczowej w analizie związków farmaceutycznych w próbkach wód środowiskowych

2015

chromatografia oddziaływań hydrofilowychchromatografia dwuwymiarowazanieczyszczenia wód i ściekówHILICfarmaceutyki w wodach
researchProduct

meso-Aryl-substituted free-base porphyrins: formation, structure and photostability of diprotonated species

2015

Susceptibility to interact with trifluoroacetic acid (TFA) of selected free-base porphyrins, including a novel lipophilic 3-n-pentadecyl(phenoxy)-ethoxy-phenyl-substituted porphyrin, and photostability of their diprotonated compounds was explored in benzene and N,N-dimethylformamide (DMF). Results have been discussed in terms of the commonly applied pK a -based procedure and confronted with a simple approach derived from experimentally-determined correlations reflecting the porphyrins affinity for TFA. Density functional theory (DFT) has proved the porphyrin moiety creates stable diprotonated species involving two TFA molecules, in which the fluorine atoms effectively contribute to the over…

computationChemistry(all)free-base porphyrinsprotonationProtonationProtonationphotobleaching010402 general chemistryPhotochemistryDFT01 natural sciencesFree-base porphyrinchemistry.chemical_compoundPolymer chemistryTrifluoroacetic acidlipophilic porphyrinsMoietyMoleculeReactivity (chemistry)Lipophilic porphyrinPhotobleaching010405 organic chemistryArylDFT computationFree baseGeneral ChemistryPorphyrin0104 chemical scienceschemistryResearch on Chemical Intermediates
researchProduct

Methionine in a protein hydrophobic core drives tight interactions required for assembly of spider silk

2019

Web spiders connect silk proteins, so-called spidroins, into fibers of extraordinary toughness. The spidroin N-terminal domain (NTD) plays a pivotal role in this process: it polymerizes spidroins through a complex mechanism of dimerization. Here we analyze sequences of spidroin NTDs and find an unusually high content of the amino acid methionine. We simultaneously mutate all methionines present in the hydrophobic core of a spidroin NTD from a nursery web spider’s dragline silk to leucine. The mutated NTD is strongly stabilized and folds at the theoretical speed limit. The structure of the mutant is preserved, yet its ability to dimerize is substantially impaired. We find that side chains of…

congenital hereditary and neonatal diseases and abnormalitiesProtein Foldinggenetic structuresProtein ConformationScienceSilkmacromolecular substancesCircular dichroismcomplex mixturesArticleMethionineddc:590ddc:570AnimalsAmino Acid Sequencelcsh:ScienceFluorescence spectroscopySequence Homology Amino AcidfungiQtechnology industry and agricultureSpidersSpectrometry FluorescenceMutationThermodynamicslcsh:QProtein MultimerizationFibroinsSolution-state NMRHydrophobic and Hydrophilic InteractionsAlgorithmsNature Communications
researchProduct

Crystal structures of (E)-3-(4-hydroxybenzylidene)chroman-4-one and (E)-3-(3-hydroxybenzylidene)-2-phenylchroman-4-one

2019

The synthesis and crystal structures of (E)-3-(4-hydroxybenzylidene)chroman-4-one, C16H12O3, I, and (E)-3-(3-hydroxybenzylidene)-2-phenylchroman-4-one, C22H16O3, II, are reported. These compounds are of interest with respect to biological activity. Both structures display intermolecular C—H...O and O—H...O hydrogen bonding, forming layers in the crystal lattice. The crystal structure of compound I is consolidated by π–π interactions. The lipophilicity (logP) was determined as it is one of the parameters qualifying compounds as potential drugs. The logP value for compound I is associated with a larger contribution of C...H interaction in the Hirshfeld surface.

crystal structurelipophilicity index010405 organic chemistryChemistryHydrogen bondGeneral ChemistryCrystal structure010402 general chemistryCondensed Matter Physicschromanone derivative01 natural sciences0104 chemical scienceslcsh:ChemistryCrystallographylcsh:QD1-999hirshfeld surface analysisLipophilicityHirshfeld surface analysisGeneral Materials Scienceflavanone derivativeActa Crystallographica Section E Crystallographic Communications
researchProduct

Non-linear optical, electrochemical and spectroelectrochemical properties of amphiphilic inner salt porphyrinic systems

2016

Three zwitterionic meso-substituted A3B- and AB2C-porphyrins containing one sulfonato alkylpyridinium substituent and three or two alkoxy-substituted phenyl groups were synthesized in good yield and fully characterized as to their physicochemical properties by a variety of techniques. This new series of inner salt donor-acceptor meso-substituted porphyrin derivatives were prepared for possible application as amphiphilic probes for membrane insertion in the area of combined second-harmonic and two-photon fluorescence cellular microscopy. To this end, the linear and nonlinear optical properties of the compounds were characterized, together with their electrochemical and spectroelectrochemica…

designInorganic chemistrySubstituentamphiphilic inner salt02 engineering and technology010402 general chemistryElectrochemistryPhotochemistry[ CHIM ] Chemical Scienceselectron-accepting moieties01 natural sciencesnon-linear optical propertychemistry.chemical_compoundAmphiphilechromophores[CHIM]Chemical SciencesMoleculeChemistryfrequency dispersionSecond-harmonic generationspectroelectrochemistrydipolar complexesGeneral Chemistry021001 nanoscience & nanotechnologyPorphyrinFluorescence0104 chemical sciences2nd-harmonic generationelectrochemistrymicroscopycharge-transferfluorescenceAbsorption (chemistry)hyper-rayleigh scattering0210 nano-technologyJournal of Porphyrins and Phthalocyanines
researchProduct