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Computational Insight Into the Enantioselectivity of Homoboroproline Catalyzed Asymmetric Aldol Reaction
Dulger, Habibe; Sari, Ozlem; Demirel, Nadir; Erdem, Safiye S. (WILEY-V C H VERLAG GMBH, 2019)Chiral amino boronic acids and their derivatives have a wide range of applications including enzyme inhibitors, anti-cancer agents and molecular sensors. They also draw attention as effective catalysts. Recently, a new ... -
Design and Synthesis of Pyrrolotriazepine Derivatives: An Experimental and Computational Study
Menges, Nurettin; Sari, Ozlem; Abdullayev, Yusif; Erdem, Safiye Sag; Balci, Metin (AMER CHEMICAL SOC, 2013)The pyrrole derivatives having carbonyl groups at the C-2 position were converted to N-propargyl pyrroles. The reaction of those compounds with hydrazine monohydrate resulted in the formation of 5H-pyrrolo[2,1-d][1,2,5]-triazepine ... -
Functionalization of oxabenzonorbornadiene: Manganese(III)-mediated oxidative addition of dimedone
Caliskan, Rasit; Sari, Ozlem; Balci, Metin (WILEY, 2017)3-Chloro-1,2,3,4-tetrahydro-1,4-epoxynaphthalen-2-yl)-3-hydroxy-5,5-dimethylcy-clohex- 2-en-1-one, synthesized by the reaction of oxabenzonorbornadiene with Mn(OAc)(3) and dimedone in the presence of HCl in acetic acid, ... -
Mechanisms of the Reaction between Polyhalogenated Nitrobutadienes and Electron-Deficient Anilines: Computational Modeling
Sari, Ozlem; Erdem, Safiye Sag; Kaufmann, Dieter E. (AMER CHEMICAL SOC, 2014)Nitro-substituted polyhalogenated butadienes are valuable synthetic precursors for polyfunctionalized bioactive heterocyclic compounds. Recently, a new reaction between 2-nitroperchloro-1,3-butadiene and electron-deficient ... -
Mechanistic Insights into the Reaction of N-Propargylated Pyrrole- and Indole-Carbaldehyde with Ammonia, Alkyl Amines, and Branched Amines: A Synthetic and Theoretical Investigation
Sari, Ozlem; Seybek, Ali Fatih; Kaya, Serdal; Menges, Nurettin; Erdem, Safiye Sag; Balci, Metin (WILEY-V C H VERLAG GMBH, 2019)The reaction of pyrrole- and indole-carbaldehydes having a propargyl group attached to the nitrogen atom with various amines was studied. The reaction with ammonia formed pyrrolo[1,2-a]pyrazine and pyrazino[1,2-a]indole ... -
A three-component, one-pot synthesis of 1,8-naphthyridine and isoxazole derivatives and computational elucidation of the mechanism
Guleli, Muge; Erdem, Safiye S.; Ocal, Nuket; Erden, Ihsan; Sari, Ozlem (SPRINGER, 2019)An efficient and general method for the synthesis of substituted 3,4-dimethylisoxazolo[5,4-b]pyridine-5-carboxamide and benzo[b][1,8]naphthyridine-3-carboxamide derivatives by using 2,2,6-trimethyl-4H-1,3-dioxin-4-one, ... -
Unexpected regioselectivity observed in the bromination and epoxidation reactions of p-benzoquinone-fused norbornadiene: An experimental and computational study
Essiz, Selcuk; Dalkilic, Erdin; Sari, Ozlem; Dastan, Arif; Balci, Metin (PERGAMON-ELSEVIER SCIENCE LTD, 2017)The bromination reaction of p-benzoquinone-fused norbornadiene was studied at various temperatures (-78, 50, 0, 25, and 77 degrees C). At room temperature, the double bonds of the p-benzoquinone units were mainly brominated. ...