Search results for "Azole"

showing 10 items of 2392 documents

Fluorinated heterocyclic compounds: an assay on the photochemistry of some fluorinated 1-oxa-2-azoles: an expedient route to fluorinated heterocycles

2004

Abstract Photoinduced heterocyclic rearrangements of ON bond-containing azoles have been claimed in the synthesis of target fluorinated heterocyclic compounds. In this context, the photochemical behavior of some fluorinated 1,2,4-oxadiazoles has been investigated. Irradiations of 3-amino-5-perfluoroalkyl-1,2,4-oxadiazoles at λ =313 nm in methanol gave open-chain products arising from a reaction of the nucleophilic solvent with either the first formed ring-photolytic species or with a nitrilimine moiety generated from it. Differently, irradiations in methanol with the presence of triethylamine (TEA) followed competing phototransposition pathways leading to the ring-isomers 2-amino-5-perfluo…

synthesisFluorinated heterocyclic compounds Oxadiazoles Synthesis Photochemistry Molecular rearrangementsfluorinated heterocyclic compounds;oxadiazoles;synthesis;photochemistry;molecular rearrangementsmolecular rearrangementsContext (language use)PhotochemistryBiochemistryInorganic Chemistrychemistry.chemical_compoundNucleophileEnvironmental ChemistryMoietySettore CHIM/01 - Chimica AnaliticaPhysical and Theoretical ChemistryTriethylaminephotochemistryNitrilimineOrganic ChemistryoxadiazolesSettore CHIM/06 - Chimica OrganicaGeneral MedicineSolventchemistryfluorinated heterocyclic compoundsMethanolSolvolysis
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One-pot synthesis and characterization of subnanometre-size benzotriazolate protected copper clusters

2012

A simple one-pot method for the preparation of subnanometre-size benzotriazolate (BTA) protected copper clusters, Cu(n)BTA(m), is reported. The clusters were analyzed by optical and infrared spectroscopy, mass spectrometry and transmission electron microscopy together with computational methods. We suggest a structural motif where the copper core of the Cu(n)BTA(m) clusters is protected by BTA-Cu(i)-BTA units.

ta114Inorganic chemistryOne-pot synthesischemistry.chemical_elementInfrared spectroscopyTriazolesMass spectrometryCopperCharacterization (materials science)CrystallographychemistryCoordination ComplexesTransmission electron microscopyQuantum TheorySpectrophotometry UltravioletGeneral Materials ScienceStructural motifta116CopperNanoscale
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Evidence of Weak Halogen Bonding: New Insights on Itraconazole and its Succinic Acid Cocrystal

2012

Exact knowledge of the crystal structure of drugs and lead compounds plays a significant role in the fields of crystal engineering, docking, computational modeling (drug–receptor interactions), and rational design of potent drugs in pharmaceutical chemistry. The succinic acid cocrystal of the systemic antifungal drug, itraconazole, reported by Remenar et al. (J. Am. Chem. Soc.2003, 125, 8456–8457) (CSD: IKEQEU), represents one of the classical examples displaying a molecular fitting mechanism in the solid state. In this work, we disclose the X-ray single-crystal structure of the cis-itraconazole–succinic acid (2:1) cocrystal and found that it differs slightly from the previously reported st…

ta214Halogen bondta114Stereochemistryta221Rational designAntifungal drugGeneral ChemistryCondensed Matter PhysicsCrystal engineeringCocrystalCocrystalchemistry.chemical_compoundsymbols.namesakechemistrySuccinic acidDocking (molecular)symbolsGeneral Materials ScienceHalogen bondingItraconazolevan der Waals forceta116ta218Crystal Growth & Design
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CCDC 1432272: Experimental Crystal Structure Determination

2016

Related Article: Anna Świtlicka-Olszewska, Joanna Palion-Gazda, Tomasz Klemens, Barbara Machura, Julia Vallejo, Joan Cano, Francesc Lloret, Miguel Julve|2016|Dalton Trans.|45|10181|doi:10.1039/C6DT01160H

tetrakis(1-Benzyl-1H-imidazole)-bis(dicyanamide)-cobalt(ii)Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1867830: Experimental Crystal Structure Determination

2019

Related Article: Anna Świtlicka, Joanna Palion-Gazda, Barbara Machura, Joan Cano, Francesc Lloret, Miguel Julve|2019|Dalton Trans.|48|1404|doi:10.1039/C8DT03965H

tetrakis(1-benzyl-1H-imidazole)-bis[(iminomethylidene)propanedinitrilato]-cobalt(ii)Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1867829: Experimental Crystal Structure Determination

2019

Related Article: Anna Świtlicka, Joanna Palion-Gazda, Barbara Machura, Joan Cano, Francesc Lloret, Miguel Julve|2019|Dalton Trans.|48|1404|doi:10.1039/C8DT03965H

tetrakis(1-benzyl-2-methyl-1H-imidazole)-bis[(iminomethylidene)propanedinitrilato]-cobalt(ii)Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1969471: Experimental Crystal Structure Determination

2021

Related Article: Maria-Gabriela Alexandru, Diana Visinescu, Beatrice Cula, Sergiu Shova, Renato Rabelo, Nicolás Moliner, Francesc Lloret, Joan Cano, Miguel Julve|2021|Dalton Trans.|50|14640|doi:10.1039/D1DT02512K

tetrakis(mu-cyano)-dicyano-bis(hydrogen tripyrazolylborate)-bis(2-(2-pyridyl)imidazole)-tetrakis(nitrato)-bis(triphenylphosphine oxide)-di-iron-di-neodymium acetonitrile solvateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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N-[3-Methyl-1-phenyl-1-(1H-tetrazol-1-yl)butan-2-yl]acetamide

2016

In the molecule of the title compound, C14H19N5O, the dihedral angle formed between the tetrazole and phenyl rings is 68.39 (4)°. In the crystal, molecules are linked by N—H...N, C—H...N and C—H...O hydrogen bonds to form two-dimensional networks extending parallel to thebcplane.

tetrazolecrystal structureacetamidebiologyChemistryHydrogen bondPlane (geometry)StereochemistryGeneral MedicineCrystal structureDihedral angle010402 general chemistry010403 inorganic & nuclear chemistrybiology.organism_classification01 natural sciences0104 chemical sciencesCrystalchemistry.chemical_compoundCrystallographyhydrogen bondslcsh:QD901-999TetraTetrazolelcsh:CrystallographyAcetamideIUCrData
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MTOR inhibitor-based combination therapies for pancreatic cancer

2018

Background: Although the mechanistic target of rapamycin (MTOR) kinase, included in the mTORC1 and mTORC2 signalling hubs, has been demonstrated to be active in a significant fraction of patients with pancreatic ductal adenocarcinoma (PDAC), the value of the kinase as a therapeutic target needs further clarification. Methods: We used Mtor floxed mice to analyse the function of the kinase in context of the pancreas at the genetic level. Using a dual-recombinase system, which is based on the flippase-FRT (Flp-FRT) and Cre-loxP recombination technologies, we generated a novel cellular model, allowing the genetic analysis of MTOR functions in tumour maintenance. Cross-species validation and pha…

therapeutic resistance0301 basic medicineCancer ResearchCell SurvivalMAP Kinase Signaling Systempancreatic cancerAntineoplastic AgentsContext (language use)Mechanistic Target of Rapamycin Complex 2mTORC1Mechanistic Target of Rapamycin Complex 1BiologymTORC2BortezomibMice03 medical and health sciencesCell Line TumorPancreatic cancermedicineAnimalsHumansExtracellular Signal-Regulated MAP KinasesMechanistic target of rapamycinPI3K/AKT/mTOR pathwayBenzoxazolesKinaseMTORTOR Serine-Threonine Kinasesmedicine.diseaseddc:3. Good healthPancreatic NeoplasmsPyrimidines030104 developmental biologyOncologybiology.proteinCancer researchCamptothecinTOR Serine-Threonine KinasesPhosphatidylinositol 3-KinaseTranslational TherapeuticsProto-Oncogene Proteins c-aktBiologieCarcinoma Pancreatic Ductal
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Thiazole Analogues of the Marine Alkaloid Nortopsentin as Inhibitors of Bacterial Biofilm Formation

2020

Anti-virulence strategy is currently considered a promising approach to overcome the global threat of the antibiotic resistance. Among different bacterial virulence factors, the biofilm formation is recognized as one of the most relevant. Considering the high and growing percentage of multi-drug resistant infections that are biofilm-mediated, new therapeutic agents capable of counteracting the formation of biofilms are urgently required. In this scenario, a new series of 18 thiazole derivatives was efficiently synthesized and evaluated for its ability to inhibit biofilm formation against the Gram-positive bacterial reference strains Staphylococcus aureus ATCC 25923 and S. aureus ATCC 6538 a…

thiazole derivativeAquatic OrganismsStaphylococcus aureusIndolesantibiotic resistanceSettore BIO/05 - ZoologiaPharmaceutical ScienceMicrobial Sensitivity TestsBacterial growthSettore BIO/19 - Microbiologia Generalemedicine.disease_cause01 natural sciencesArticlenortopsentinAnalytical ChemistryMicrobiologylcsh:QD241-441Inhibitory Concentration 50chemistry.chemical_compoundAlkaloidsAntibiotic resistancelcsh:Organic chemistryDrug DiscoverymedicinePhysical and Theoretical ChemistryThiazoleStrain (chemistry)010405 organic chemistryPseudomonas aeruginosamarine alkaloids analoguesAlkaloidOrganic ChemistryImidazolesBiofilmantibiofilm agentsSettore CHIM/08 - Chimica Farmaceuticamarine alkaloids analogueantibiofilm agent0104 chemical sciencesThiazoles010404 medicinal & biomolecular chemistrychemistryChemistry (miscellaneous)Staphylococcus aureusBiofilmsPseudomonas aeruginosathiazole derivativesMolecular MedicineMolecules
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