Search results for "Malononitrile"

showing 10 items of 15 documents

Functionalised diimidazolium salts: the anion effect on the catalytic ability

2016

The catalytic ability of some functionalised diimidazolium ionic liquids was tested using the Michael addition of malononitrile to t-chalcone as probe reaction. Diimidazolium salts characterized by the presence of 1-(1-imidazolylmethyl)-3,5-di-[1-(3-octylimidazolylmethyl)]benzene cation and differing in the anion structure were used. Both mono- and dianions were employed and among these some chiral anions generally used as organocatalysts were taken into account. Data collected were analysed both as function of ionic liquids structure and basicity, evaluated using the Hammett basicity function. Although the use of chiral anions did not allow performing a stereochemical control of the reacti…

010405 organic chemistryGeneral Chemical EngineeringSettore CHIM/06 - Chimica OrganicaGeneral Chemistry010402 general chemistry01 natural sciencesIonic Liquids Michael Reaction Base catalysis0104 chemical sciencesCatalysisIonchemistry.chemical_compoundchemistryIonic liquidPolymer chemistryMichael reactionOrganic chemistryBenzeneMalononitrileRSC Advances
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6-Amino-1-benzyl-4-(4-chloro-phen-yl)-3-(4-pyrid-yl)-1,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile.

2008

The crystal structure of the title compound, C25H18ClN5O, was determined in the course of our studies on the synthesis of 1,4-dihydropyrano[2,3-c]pyrazole as an inhibitor of the p38 mitogen-activated protein kinase (MAPK). The compound was prepared via a base-catalysed synthesis from 1-benzyl-3-(4-pyridyl)-1H-pyrazol-5(4H)-one with p-chloroaldehyde and malononitrile. The crystal data obtained were used to generate a three-dimensional pharmacophore model for in silico database screening. The phenyl ring is disordered over two positions, with site occupancy factors of 0.55 and 0.45. The dihedral angles between the 1,4-dihydropyrano[2,3-c]pyrazole unit and the chlorophenyl and pyridine rings a…

ChemistryGeneral ChemistryCrystal structureDihedral anglePyrazoleCondensed Matter PhysicsRing (chemistry)BioinformaticsMedicinal chemistryOrganic Paperslcsh:Chemistrychemistry.chemical_compoundlcsh:QD1-999Crystal dataPyridineGeneral Materials SciencePharmacophoreMalononitrileActa crystallographica. Section E, Structure reports online
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Glass-Forming Nonsymmetric DWKdyes with 5,5,5-Triphenylpentyl and Piparazine Moieties for Lightamplification Studies

2018

This work has been supported by the European Regional Development Fund within the Activity 1.1.1.2 “Post-doctoral Research Aid” of the Specific Aid Objective 1.1.1 “To increase the research and innovative capacity of scientific institutions of Latvia and the ability to attract external financing, investing in human resources and infrastructure” of the Operational Programme “Growth and Employment” (No. 1.1.1.2/VIAA/1/16/035). Financial support provided by A. Riekstins SIA “Mikrotīkls” donation, administered by the University of Latvia is greatly appreciated. There are no conflicts of interest to declare.

PhotoluminescenceInfraredmolecular glasses02 engineering and technology010402 general chemistry01 natural sciencesamplified spontaneous emissionchemistry.chemical_compoundPolymer chemistry:NATURAL SCIENCES:Physics [Research Subject Categories]MoleculeThermal stability4 H -pyran-4-ylideneamplified spontaneous emission; laser dyes; 4H-pyran-4-ylidene; triphenyl moieties; piperazine moieties; molecular glasseslaser dyesMalononitrileRenewable Energy Sustainability and the Environmentpiperazine moieties021001 nanoscience & nanotechnologyAtomic and Molecular Physics and Optics0104 chemical sciencesPiperazinechemistryCovalent bond0210 nano-technologyLuminescencetriphenyl moieties
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An efficient synthesis of pyrrolo[3',2':4,5]thiopyrano[3,2-b]pyridin-2-one: a new ring system of pharmaceutical interest

2012

Abstract A series of pyrrolo[3′,2′:4,5]thiopyrano[3,2- b ]pyridin-2-ones 4 was prepared in good yields by reacting enaminoketones with cyanomethylene active compounds such as phenylsulfonylacetonitrile, benzoylacetonitrile, and malononitrile. Derivatives of the title ring system were tested by the National Cancer Institute of Bethesda against a panel of about 60 human tumor cell lines, and one of them showed inhibitory activity against all cancer cell lines reaching on 48% of them GI 50 values at submicromolar level and on the majority of the remaining ones in the low micromolar concentration.

Pyrrolo[3'; 2':4; 5]thiopyrano[3; 2-b]pyridin-2-one; Angelicin; Antiproliferative activity; EnaminoketonesPyrrolo[3'2':45]thiopyrano[32-b]pyridin-2-one Angelicin Antiproliferative activity EnaminoketonesStereochemistryChemistryAngelicinOrganic ChemistryAntiproliferative activityRing (chemistry)Pyrrolo[3'Biochemistry5]thiopyrano[3Settore CHIM/08 - Chimica FarmaceuticaHuman tumorchemistry.chemical_compound2':4EnaminoketonesDrug DiscoveryCancer cell linesMalononitrile2-b]pyridin-2-one
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CCDC 1448363: Experimental Crystal Structure Determination

2016

Related Article: Antonia Morherr, Sebastian Witt, Alisa Chernenkaya, Jan-Peter Bäcker, Gerd Schönhense, Michael Bolte, Cornelius Krellner|2016|Physica B: Condensed Matter(Amsterdam)|496|98|doi:10.1016/j.physb.2016.05.023

Space GroupCrystallography22'-(25-difluorocyclohexa-25-diene-14-diylidene)dimalononitrile piceneCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1448361: Experimental Crystal Structure Determination

2016

Related Article: Antonia Morherr, Sebastian Witt, Alisa Chernenkaya, Jan-Peter Bäcker, Gerd Schönhense, Michael Bolte, Cornelius Krellner|2016|Physica B: Condensed Matter(Amsterdam)|496|98|doi:10.1016/j.physb.2016.05.023

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters22'-(2356-tetrafluorocyclohexa-25-diene-14-diylidene)dimalononitrile phenanthreneExperimental 3D Coordinates
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CCDC 1448362: Experimental Crystal Structure Determination

2016

Related Article: Antonia Morherr, Sebastian Witt, Alisa Chernenkaya, Jan-Peter Bäcker, Gerd Schönhense, Michael Bolte, Cornelius Krellner|2016|Physica B: Condensed Matter(Amsterdam)|496|98|doi:10.1016/j.physb.2016.05.023

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters22'-cyclohexa-25-diene-14-diylidenedimalononitrile piceneExperimental 3D Coordinates
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CCDC 1448360: Experimental Crystal Structure Determination

2016

Related Article: Antonia Morherr, Sebastian Witt, Alisa Chernenkaya, Jan-Peter Bäcker, Gerd Schönhense, Michael Bolte, Cornelius Krellner|2016|Physica B: Condensed Matter(Amsterdam)|496|98|doi:10.1016/j.physb.2016.05.023

Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates22'-(25-difluorocyclohexa-25-diene-14-diylidene)dimalononitrile phenanthrene
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A novel polynitrile ligand with different coordination modes: Synthesis, structure and magnetic properties of the series [M(tcnoprOH)2(H2O)2] (M=Mn, …

2008

International audience; A novel polynitrile ligand (tcnoprOH− = [(NC)2CC(OCH2CH2CH2OH)C(CN)2]−) with up to five potentially coordinating groups has been synthesized in a one-pot reaction from a cyclic acetal and malononitrile. The combination of this novel ligand with different transition metal ions has led to the synthesis of two different structural types with the same formula but with different coordination modes in the ligand. Mn(II) and Cu(II) lead to a μ2-N,O-coordinating mode in the series of compounds formulated as [M(N,O-tcnoprOH)2(H2O)2] (M = MnII (1) and CuII (2)), whereas Co(II) and, most probably Ni(II), lead to a μ2-N,N′-coordinating mode in [Co(N,N′-tcnoprOH)2(H2O)2] (3). Bot…

StereochemistryMetal ions in aqueous solutionZero field splitting[CHIM.INOR]Chemical Sciences/Inorganic chemistry010402 general chemistry01 natural sciencesAnalytical ChemistryInorganic ChemistryPolynitrile ligandschemistry.chemical_compoundParamagnetismGroup (periodic table)Magnetic properties[CHIM]Chemical Sciences[CHIM.COOR]Chemical Sciences/Coordination chemistrySpectroscopyMalononitrile010405 organic chemistryLigandOrganic ChemistryAcetalMagnetic chains3. Good health0104 chemical sciencesCrystallographychemistryChain complexesDerivative (chemistry)
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Several Derivatives of 6-(Tert-Butyl)-4H-Pyran-4-Ylidene Malononitrile with Different Amorphous Phase Promoting Substituents for Light-Amplification …

2019

A series of glassy 6-(tert-butyl)-4H-pyran-4-ylidene malononitrile (DCM) derivatives with covalently attached amorphous state promoting bulky 1,1,1-triphenylmethyl (trityl) moieties through several chemical design approaches have been synthesized and investigated for suitability in organic solid state laser applications. Results showed that the bonding type of such functional groups had a considerable influence on glass structure forming dye thermal properties and a slight influence on their optical properties. Thermal stability up to 346 °C was achieved with glass transitions in the range from 39 to 138 °C. Incorporation of bulky triphenyl substituents via ester groups showed remarkable am…

Tert butylAmplified spontaneous emissionDye laserMaterials scienceMechanical EngineeringPhotochemistryAmorphous phasechemistry.chemical_compoundchemistryMechanics of MaterialsPyranMolecular glassesGeneral Materials ScienceMalononitrileKey Engineering Materials
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