Search results for "domino"

showing 10 items of 74 documents

A synthetic approach to new polycyclic ring system of biological interest through domino reaction: indolo[2,3-e][1,2,3]triazolo[1,5-a]pyrimidine

2006

Abstract The title indolo-triazolo-pyrimidines were obtained from 3-azidoindoles and can be used as models for the design of DNA-interactive compounds. Hetero-domino reaction of azidoindoles/pyrroles and acetonitriles constitutes the synthetic entry to annelated 1,2,3-triazolo[1,5- a ]pyrimidines.

Indolo-triazolo-pyrimidinechemistry.chemical_compoundAcetonitrilesPyrimidinechemistryCascade reactionDocking (molecular)StereochemistryOrganic ChemistryDrug DiscoveryDomino reactionBiochemistryDockingTetrahedron Letters
researchProduct

A Domino Ring‐Closure Followed by Retro‐Diels–Alder Reaction for the Preparation of Pyrimido[2,1‐ a ]isoindole Enantiomers

2016

A simple method was developed to prepare pyrimido[2,1-a]isoindole derivatives by using di-endo- and di-exo-ethyl 3-aminobicyclo[2.2.1]hept-5-ene-2-carboxylate enantiomers as chiral sources. The method is based on a domino ring-closure reaction of norbornene 2-aminohydroxamic acid followed by microwave-induced retro-Diels–Alder reaction. In the case of enantiomeric starting substances, the chirality is transferred from norbornene derivatives to pyrimido[2,1-a]isoindoles. The configurations of the synthesized compounds were determined by 1D and 2D NMR spectroscopy [based on 2D NOE cross-peaks and 3JH,H coupling constants] and X-ray crystallography.

Isoindoles010405 organic chemistryStereochemistryChemistrydomino reactionsOrganic Chemistry010402 general chemistryRing (chemistry)Retro-Diels–Alder reaction01 natural sciencesMedicinal chemistryChiral resolutionmicrowave chemistry0104 chemical scienceschemistry.chemical_compoundsynthetic methodschiral resolutionnitrogen heterocyclesPhysical and Theoretical ChemistryEnantiomerIsoindoleChirality (chemistry)ta116NorborneneEuropean Journal of Organic Chemistry
researchProduct

Mākslas galerijas un izstāžu pārvaldības sistēma

2017

Šis dokuments ir kvalifikācijas darba ietvaros izstrādātās Mākslas galerijas un izstāžu pārvaldības sistēmas projekta dokumentācija, kas sastāv no programmatūras prasību specifikācijas, datu bāzes projektējuma, ārējās saskarnes apraksta un projekta organizācijas apraksta. Kvalifikācijas darba mērķis ir izstrādāt datora lietojumprogrammu, kuras galvenais uzdevums ir atvieglot mākslas galeriju darbu un pārvaldību, un izstāžu organizēšanu, kā arī veicināt sadarbību starp mākslas darbu izplatītājiem un izstāžu organizatoriem. Lietotne papildus sniedz iespēju apkopot komerciālo un labdarības izstāžu komerciālos panākumus. Mākslas galeriju darbinieki lietotnei var pievienot galerijas telpas un to…

IzstādeIBM NotesDomino DesignerDatorzinātneEksponātsMākslas galerija
researchProduct

Multicentre propensity score-matched analysis of conventional versus extended abdominoperineal excision for low rectal cancer

2014

Abstract Background Abdominal perineal excision (APE) was originally described with levator ani removal for rectal cancer. An even wider, more aggressive extralevator resection for APE has been proposed. Although some surgeons are performing a very wide ‘extralevator APE (ELAPE)’, there are few data to recommend it routinely. This multicentre study aimed to compare outcomes of APE and ELAPE. Methods A multicentre propensity case-matched analysis comparing two surgical approaches (APE and ELAPE) was performed. All patients who underwent abdominoperineal resection of a rectal tumour were considered for the analysis. Tumour height was defined by magnetic resonance imaging measurement and patie…

MaleReoperationmedicine.medical_specialtymedicine.medical_treatmentPerforation (oil well)Anal CanalPerineumPostoperative ComplicationsmedicineHumansStage (cooking)Propensity ScoreNeoadjuvant therapyAgedRectal Neoplasmsbusiness.industryAbdominoperineal resectionPostoperative complicationMiddle AgedAnal canalTumor BurdenPerineumSurgerymedicine.anatomical_structureCase-Control StudiesPropensity score matchingFemaleSurgeryNeoplasm Recurrence LocalbusinessBritish Journal of Surgery
researchProduct

Synthesis of Pyrrolo[1,2-a]pyrimidine Enantiomers via Domino Ring-Closure followed by Retro Diels-Alder Protocol

2017

From 2-aminonorbornene hydroxamic acids, a simple and efficient method for the preparation of pyrrolo[1,2-a]pyrimidine enantiomers is reported. The synthesis is based on domino ring-closure followed by microwave-induced retro Diels-Alder (RDA) protocols, where the chirality of the desired products is transferred from norbornene derivatives. The stereochemistry of the synthesized compounds was proven by X-ray crystallography. The absolute configuration of the product is determined by the configuration of the starting amino hydroxamic acid. peerReviewed

Models MolecularMagnetic Resonance SpectroscopyPyrimidinehydroxamic acidStereochemistryPharmaceutical ScienceChemistry Techniques SyntheticCrystallography X-RayHydroxamic Acids010402 general chemistryRing (chemistry)01 natural sciencesArticleDominoAnalytical Chemistrymicrowave chemistrylcsh:QD241-441chemistry.chemical_compoundlcsh:Organic chemistryDrug DiscoveryPhysical and Theoretical ChemistryN-heterocyclesta116Norbornenedomino reactions; hydroxamic acid; microwave chemistry; <i>N</i>-heterocycles; retro Diels-Alder reactionHydroxamic acidMolecular Structure010405 organic chemistryretro Diels-Alder reactionOrganic Chemistrydomino reactionsAbsolute configurationStereoisomerism0104 chemical sciencesPyrimidineschemistryChemistry (miscellaneous)Molecular MedicineEnantiomerChirality (chemistry)Molecules; Volume 22; Issue 4; Pages: 613
researchProduct

Design and Synthesis of 4-Substituted Indolo[3,2-e][1,2,3]triazolo[1,5-a]pyrimidine Derivatives with Antitumor Activity

2008

New derivatives of the indolo[3,2- e][1,2,3]triazolo[1,5- a]pyrimidine system, substituted in the 4 position, were designed as novel antitumor agents because of their theoretical capability to form stable complexes with DNA fragments. The calculated free energies of binding were found in the range -12.76 --> -39.68 Kcal/mol. The docking studies revealed a common binding mode with the chromophore intercalated between GC base pairs, whereas the side chain lies along the minor groove. Compounds, selected on the basis of the docking studies and suitably synthesized, showed antiproliferative activity against each type of tumor cell line investigated, generally in the low micromolar range. The mo…

Models MolecularSEQUENCE SPECIFICITYMolecular modelPyrimidineStereochemistryDNA-BINDINGBIOLOGICAL INTERESTStereoisomerismAntineoplastic AgentsPyrimidinonesChemical synthesisHeterocyclic Compounds 4 or More RingsAUTOMATED DOCKINGchemistry.chemical_compoundStructure-Activity RelationshipCell Line TumorDrug DiscoveryStructure–activity relationshipHumansALGORITHMBinding siteCell ProliferationBinding SitesMolecular StructureChemistryBiological activityStereoisomerismDOMINO REACTIONDNADocking (molecular)Drug DesignNATIONAL-CANCER-INSTITUTEACTINOMYCIN-DMolecular MedicineCOMPLEXESDrug Screening Assays AntitumorTUMOR-CELL-LINES
researchProduct

A Molecular Electron Density Theory Study of the Synthesis of Spirobipyrazolines through the Domino Reaction of Nitrilimines with Allenoates

2019

The reaction of diphenyl nitrilimine (NI) with methyl 1-methyl-allenoate yielding a spirobipyrazoline has been studied within molecular electron density theory (MEDT) at the MPWB1K/6-311G(d) computational level in dichloromethane. This reaction is a domino process that comprises two consecutive 32CA reactions with the formation of a pyrazoline intermediate. Analysis of the relative Gibbs free energies indicates that both 32CA reactions are highly regioselective, the first one being also completely chemoselective, in agreement with the experimental outcomes. The geometries of the TSs indicate that they are associated to asynchronous bond formation processes in which the shorter distance invo…

Models Molecular[3+2] cycloaddition reactionsMolecular ConformationPharmaceutical SciencePyrazoline010402 general chemistrynitrilimines7. Clean energy01 natural sciencesArticleallenoatesAnalytical Chemistrylcsh:QD241-441symbols.namesakechemistry.chemical_compoundlcsh:Organic chemistryNucleophileCascade reactionComputational chemistryDrug DiscoverySpiro CompoundsPhysical and Theoretical ChemistryDichloromethaneCycloaddition ReactionMolecular Structure010405 organic chemistryChemistryNitrilimineOrganic Chemistrydomino reactionsmolecular electron density theoryRegioselectivityspirobipyrazolinesModels Theoretical0104 chemical sciencesGibbs free energyChemistry (miscellaneous)ElectrophilesymbolsMolecular MedicineIminesmolecular mechanismMolecules
researchProduct

Asymmetric Synthesis of Spirocyclic β-Lactams through Copper-Catalyzed Kinugasa/Michael Domino Reactions

2018

The first copper-catalyzed highly chemo-, regio-, diastereo-, and enantioselective Kinugasa/Michael domino reaction for the desymmetrization of prochiral cyclohexadienones is described. In the presence of a chiral copper catalyst, alkyne-tethered cyclohexadienones couple with nitrones to generate the chiral spirocyclic lactams with excellent stereoselectivity (up to 97 % ee, >20:1 dr). The new method provides direct access to versatile highly functionalized spirocyclic β-lactams possessing four contiguous stereocenters, including one quaternary and one tetra-substituted stereocenter.

Molecular Structure010405 organic chemistryStereochemistryChemistryasymmetric synthesisEnantioselective synthesisGeneral MedicineGeneral Chemistrybeta-Lactams010402 general chemistry01 natural sciencesDesymmetrizationCatalysisDomino0104 chemical sciencesCatalysisStereocenterCascade reactionAlkynesβ lactamsStereoselectivityta116CopperAngewandte Chemie International Edition
researchProduct

Novel Domino Oxidative Coupling: C−C Bond Formation Sequence to Highly Functionalized Dibenzo[a,c]cycloheptenes

2011

A domino sequence involving various MoCl(5)-mediated oxidations followed by trapping and supposed [3,3]-sigmatropic rearrangement provides a fast access to the full carbon skeleton of metasequirin-B. A variety of different moieties R(1) and R(2) are tolerated.

MolybdenumMolecular StructureOxidative CouplingChemistryStereochemistryOrganic ChemistryCarbon skeletonSequence (biology)DibenzocycloheptenesBond formationBiochemistryCatalysisLignansDominoChloridesCyclizationBenzene DerivativesOxidative coupling of methanePhysical and Theoretical ChemistryOxidation-ReductionOrganic Letters
researchProduct

Electroorganic synthesis of nitriles via a halogen-free domino oxidation–reduction sequence

2015

A direct electroorganic sequence yielding nitriles from oximes in undivided cells is reported. Despite the fact that intermediate nitrile oxides might be formed, the method is viable to prepare benzonitriles without substituents ortho to the aldoxime moiety. This constant current method is easy to perform for a broad scope of substrates and employs common electrodes, such as graphite and lead.

NitrileMetals and AlloysHalogen freeNanotechnologySequence (biology)Oxidation reductionGeneral ChemistryCombinatorial chemistryCatalysisDominoSurfaces Coatings and FilmsElectronic Optical and Magnetic Materialschemistry.chemical_compoundchemistryElectrodeMaterials ChemistryCeramics and CompositesMoietyGraphiteChemical Communications
researchProduct