Reaction of 2‐(Polyfluoroacyl)cycloalkanones with Hydroxylamine

The 2‐acylcycloalkanones 1a – g and 3a – c , possessing a polyfluoroalkyl group, react with hydroxylamine regio‐ and stereoselectively to yield 4,5‐dihydroisoxazol‐5‐ols 2a – g and 4a – c , respectively, i.e., products of N‐addition to the oxo group at the cycloalkane ring (Schemes 1 and 2). The products 2 and 4 can be dehydrated under drastic conditions only (Schemes 3 and 4). The structure of one of the 4,5‐dihydroisoxazol‐5‐ols was confirmed by X‐ray crystal‐structure analysis.     

A comparative study of the behavior of cyanothioformamide and oxazolidine (thiones or iminothiones) towards some binucleophiles

Reactions of cyanothioformamides ( I ) with o‐phenylenediamines, o‐aminophenol, and anthranilic acids furnished benzimidazole ( II,III ), benzoxazole ( VII ), and quinazoline ( IX ) derivatives, respectively. Oxazolidine (thiones or iminothiones) ( IV ) were reacted with the same binucleophiles to produce quinoxaline ( V ), benzimidazole ( VI ), and quinazoline ( XI ) derivatives. © 2002 Wiley Periodicals, Inc. Heteroatom Chem 13:291–298, 2002; Published online in Wiley Interscience (www.interscience.wiley.com). DOI 10.1002/hc.10031     

Synthesis and Insulin—sensitizing Activity of a Series of 2—Benzyl—1,3—dicarbonyl Derivatives

A series of 2-benzyl-1,3-dicabonyl derivatives was synthesized.Their insulin-sensitizing activity was evaluated in 3T3-L1 preadipocyte cells.Compounds3,26 and 27 were found to possess strong insulin-sensitizing activity in vitro and were selected for further hypoglycemic evaluation in vivo.     

A Density Functional Theory Study on Electronic Structure and Second—order Nonlinear Optical Properties of Some Push—Pull Molecules

Time-dependent density-functional theory(TDDFT)has been applied to calculate the electronic structure and second-order nonlinear optical(NLO) properties of some organic molecules.The two-dimensional(2-D)charge transfer charateristics of calculated molecules were studied and compared with corresponding experimental results.All the theoretical results agree well with the measurement.For 2-D molecule with two-fold symmetry,the dominant charge transfer is off-diagonal,while for three-fold symmetry 2-D molecule,the dominant charge transfer is not only between branches and central group but also among branches.