Search results for "Heterocycle"

showing 10 items of 134 documents

An Insight into Substrate-Dependent Fluorination of some Highly Substituted Alicyclic Scaffolds

2017

The substrate-dependent fluorination of some highly-functionalized cyclopentane derivatives with multiple chiral centers has been investigated. The key steps of the stereocontrolled syntheses are the oxidative cleavage of the ring carbon–carbon double bond of readily available diexo or diendo norbornene β-amino acid derivatives followed by transformation of the resulted dialdehyde stereoisomers by reduction. Finally, substrate-directable chemodifferentiation of different types of hydroxy groups under fluorination procedures gave various densely functionalized alicyclic derivatives or heterocycles.

chemistry.chemical_classificationheterocyclescyclizationDouble bond010405 organic chemistrySubstrate (chemistry)chemistry.chemical_elementGeneral Chemistryaminohapot010402 general chemistryRing (chemistry)01 natural scienceslactones0104 chemical sciencesAmino acidchemistry.chemical_compoundAlicyclic compoundchemistryfluorineamiamino acidsFluorineOrganic chemistryCyclopentaneta116NorborneneChemistrySelect
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Traceless chirality transfer from a norbornene β-amino acid to pyrimido[2,1-a]isoindole enantiomers

2017

Abstract The synthesis of two enantiomeric pairs of pyrimidoisoindoles 9a, 9b and 10a, 10b is reported. During a domino ring-closure reaction, followed by cycloreversion, the chirality of diendo-(−)-(1R,2S,3R,4S)-3-aminobicyclo[2.2.1]hept-5-ene-2-carboxamide [(−)-1] was successfully transfered to heterocycles (+)-9a, (+)-10a, (−)-9b, (−)-10b and (−)-10c.

chemistry.chemical_classificationpharmacyamino acidsheterocycles010405 organic chemistryStereochemistrybiologyOrganic Chemistry010402 general chemistrychemistry01 natural sciencesCatalysis0104 chemical sciencesAmino acidInorganic Chemistrychemistry.chemical_compoundchemistryPhysical and Theoretical ChemistryEnantiomerIsoindoleChirality (chemistry)ta116NorborneneTetrahedron: Asymmetry
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C-H Bond Arylation of Pyrazoles at the β-Position: General Conditions and Computational Elucidation for a High Regioselectivity

2021

International audience; Direct arylation of most five-membered ring heterocycles are generally easily accessible and strongly favored at the α-position using classical palladium-catalysis. Conversely, regioselective functionalization of such heterocycles at the concurrent β-position remains currently very challenging. Herein, we report general conditions for regioselective direct arylation at the β-position of pyrazoles, while C-H α-position is free. By using aryl bromides as the aryl source and a judicious choice of solvent, the arylation reaction of variously N-substituted pyrazoles simply proceeds via β-C-H bond functionalization. The β-regioselectivity is promoted by a ligand-free palla…

chemistry.chemical_element010402 general chemistryRing (chemistry)01 natural sciencesCatalysischemistry.chemical_compoundbeta-C−H arylationsolvent effectcatalysis010405 organic chemistry[CHIM.ORGA]Chemical Sciences/Organic chemistryArylOrganic ChemistryRegioselectivityGeneral Chemistry[CHIM.CATA]Chemical Sciences/CatalysispalladiumCombinatorial chemistry0104 chemical sciences[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistrychemistryIntramolecular forceSolvent effectsProtic solventPalladiumheterocycle
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A Versatile Palladium/Triphosphane System for Direct Arylation of Heteroarenes with Chloroarenes at Low Catalyst Loading

2010

International audience; Put a ring on it: The use of an air-stable, robust palladium/tridentate phosphane catalyst in direct C[BOND]H and C[BOND]Cl activation reactions is reported (see scheme; DMAc=N,N-dimethylacetamide, TBAB=tetra-n-butylammonium bromide). Electron-rich, electron-poor, and polysubstituted furans (X=O), thiophenes (X=S), pyrroles (X=NR5), and thiazoles were arylated with chloroarenes in the presence of the catalyst.

chemistry.chemical_elementRing (chemistry)010402 general chemistry01 natural sciencesCatalysisCatalysischemistry.chemical_compound[ CHIM.CATA ] Chemical Sciences/CatalysisBromidePolymer chemistryOrganic chemistryheterocyclesbiologyChemistry010405 organic chemistrydirect arylationGeneral Chemistry[CHIM.CATA]Chemical Sciences/CatalysisGeneral Medicinebiology.organism_classificationpalladium0104 chemical sciencesC[BOND]H activationTriphosphanesynthetic methodsTetraPalladiumAngewandte Chemie
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Ring-opening metathesis of some strained bicyclic systems; stereocontrolled access to diolefinated saturated heterocycles with multiple stereogenic c…

2018

Ring-opening metathesis (ROM) of various unsaturated, constrained bicyclic ring systems has been investigated with the use of commercial ruthenium-based catalysts. Starting from various cyclodienes, the corresponding derived bicyclic lactone, lactam, and isoxazoline derivatives were submitted to ROM under ethenolysis. These functionalized, strained bicyclic systems afforded novel highly-functionalized diolefinated heterocyclic scaffolds in ROM reactions with stereocontrol, through the conservation of the configuration of the stereogenic centers of the starting compounds.

chemistry.chemical_elementstereogenic centers010402 general chemistryMetathesisRing (chemistry)01 natural sciencesFull Research PaperStereocenterlcsh:QD241-441chemistry.chemical_compoundlcsh:Organic chemistrylcsh:Sciencering openingchemistry.chemical_classificationEthenolysisheterocyclesBicyclic molecule010405 organic chemistryChemistryOrganic ChemistryCombinatorial chemistry0104 chemical sciencesRutheniumChemistryLactamfunctionalizationlcsh:QmetathesisLactoneBeilstein Journal of Organic Chemistry
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Solvated copper(I) hexafluorosilicate π-complexes based on [Cu2(amtd)2]2+ (amtd = 2-allylamino-5-methyl-1,3,4-thiadiazole) dimer

2016

[Cu2(amdt)2]SiF6·C6H6 and [Cu2(amdt)2(H2O)2]SiF6·CH3CN·2H2O (amdt = 2-allylamino-5- methyl-1,3,4-thiadiazole) were obtained by alternating-current electrochemical synthesis, starting from water–acetonitrile–benzene mixtures containing 2-allylamino-5-methyl-1,3,4- thiadiazole and CuSiF6·4H2O. The electrochemical reduction of the saturated copper hexafluorosilicate water solution beneath the neatly poured layer of acetonitrile-benzene amdt solution resulted in the formation of crystalline [Cu2(amdt)2]SiF6·C6H6. The initial stirring of the same mixture before subjecting it to the electrochemical reduction resulted in the formation of [Cu2(amdt)2(H2O)2]SiF6·CH3CN·2H2O. A sluggish hydrolysis of …

computational modelingDimerInorganic chemistrycopper(I) hexafluorosilicateschemistry.chemical_element010402 general chemistry010403 inorganic & nuclear chemistryElectrochemistry01 natural sciencesBiochemistryInorganic Chemistrychemistry.chemical_compoundHydrolysissymbols.namesakeraman spectroscopyMaterials ChemistryMother liquorPhysical and Theoretical ChemistryAcetonitrileta116heterocyclesOrganic ChemistryCopper0104 chemical scienceschemistrysymbolsPhysical chemistryRaman spectroscopyJournal of Organometallic Chemistry
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Crystal structure ofcis-1-phenyl-8-(pyridin-2-ylmethyl)dibenzo[1,2-c:2,1-h]-2,14-dioxa-8-aza-1-borabicyclo[4.4.0]deca-3,8-diene

2017

The present work describes the synthesis and crystal structure of the new B-phenyl­oxaza­borocine, C26H23BN2O2. The title compound adopts a zwitterionic form with a significant intra­molecular N→B dative bond and inter­molecular C—H⋯O inter­actions connecting mol­ecules parallel to the b axis.

crystal structureC—H...O interactionsDieneStereochemistrychemistry.chemical_elementManganeseCrystal structureRelated derivatives010402 general chemistry010403 inorganic & nuclear chemistry01 natural sciencesResearch Communications//purl.org/becyt/ford/1 [https]CrystalB-phenyldioxazaborocinechemistry.chemical_compoundzwitterionic heterocycleB-PhenyldioxazaborocineN-B Dative Bond//purl.org/becyt/ford/1.4 [https]General Materials ScienceZwitterionic HeterocycleCrystallographyC-Ho InteractionsHydrogen bondChemistryOtras Ciencias QuímicasCiencias QuímicasN—B dative bondGeneral ChemistryCondensed Matter Physics0104 chemical sciencesB-phenyl­dioxaza­borocineC—H⋯O inter­actionsQD901-999Tripodal ligandCrystal StructureCIENCIAS NATURALES Y EXACTASDeca-Acta Crystallographica Section E Crystallographic Communications
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Stabilisation of Exotic Tribromide (Br3−) Anions via Supramolecular Interaction with A Tosylated Macrocyclic Pyridinophane. A Serendipitous Case.

2020

Tetraaza-macrocyclic pyridinophane L-Ts, decorated with a p-toluenesulfonyl (tosyl

crystal structureStackingSupramolecular chemistryPharmaceutical ScienceCrystal structureAnalytical Chemistrylcsh:QD241-441symbols.namesakechemistry.chemical_compoundlcsh:Organic chemistryTosylDrug DiscoveryPyridineHirshfeld surface analysisPhysical and Theoretical ChemistryN-heterocyclesanion- interactionsTribromideHydrogen bondOrganic Chemistryanion complexesCrystallographychemistryChemistry (miscellaneous)symbolsMolecular Medicinevan der Waals forceMolecules
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Diethyl (1-benzyl-4-phenyl-3-trifluoromethyl-1H-pyrrol-2-yl)phosphonate

2017

In the title compound, C22H23F3NO3P, the dihedral angles between the pyrrole ring and the benzyl and phenyl rings are 81.38 (7) and 46.21 (8)°, respectively. The ethyl phosphate groups present with P—O—C—C torsion angles of −178.47 (10) and 106.72 (16)°, and an intramolecular C—H...O hydrogen bond occurs. In the extended structure, molecules are linked by C—H...O and C—H...F hydrogen bonds to generate [001] chains.

crystal structurefluorinated heterocycles010405 organic chemistryHydrogen bondChemistryTorsion (mechanics)Crystal structureDihedral angle010403 inorganic & nuclear chemistry01 natural sciences0104 chemical scienceschemistry.chemical_compoundCrystallographyphosphonyl grouplcsh:QD901-999lcsh:CrystallographyEthyl phosphatePyrroleIUCrData
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rac-11-Selena-12,13-diazabicyclo[10.3.0]pentadeca-10a(13a),12-dien-1-ol

2021

The title compound, C12H20N2OSe, crystallizes in strands of enantiomeric molecules connected via O—H...N hydrogen bonds. There are only slight deviations from an ideal gauche conformation in the decamethylene chain, indicating just a little strain.

crystal structureheterocyclesCrystallographyBicyclic moleculeStrain (chemistry)010405 organic chemistryHydrogen bondChemistryStereochemistryCrystal structure010403 inorganic & nuclear chemistry01 natural sciences0104 chemical sciencesQD901-999medium-sized ringseleniumDeca-IUCrData
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