A new piperazinium 4-nitro phenolate monohydrate single crystal(PNP)was grown by employing the solution growth technique piperazine and 4-nitrophenol,were the source material used for the growth,acetonitrile is used a...A new piperazinium 4-nitro phenolate monohydrate single crystal(PNP)was grown by employing the solution growth technique piperazine and 4-nitrophenol,were the source material used for the growth,acetonitrile is used as solvent.The grown crystal was characterized by Single X-ray analysis and it shows that piperazinium 4-nitrophenol monohydrate crystallizes in the monoclinic space group P2 1/c,with cell parameters a=10.902 5(4),b=6.226 1(3),c=14.031 8(5),and z=4.The lattice parameters of the substances were also determined by using powder diffraction methods.The functional groups are identified by using FTIR spectral analysis.The absorbance of title compound were analyzed using UV-Vis spectra.The thermo analytical properties of the crystal were studied using TG,DTA.展开更多
Electron impact ionization mass spectra of six new synthetic bis-piperazinium salts (M2+ 2Br-2HC1) with anti-tumor activities were obtained. Although the M+ ions and double charge ions M2+ were notobserved in E1 mass ...Electron impact ionization mass spectra of six new synthetic bis-piperazinium salts (M2+ 2Br-2HC1) with anti-tumor activities were obtained. Although the M+ ions and double charge ions M2+ were notobserved in E1 mass spectra, some strange ions such as [M-2]+ ions,[M-R]+ ions , [M-R-l]+ ions, [M-2R]+ ions and even [RX]+ ions presented in EIMS by decreasing the electron energy. These phenomena may be explained as R+ rearrangement and intermolecular reaction occurring in the condensed phase. We tried to describe the main routes of fragmentation and high sensitive mass spectra of the fragments oaboutthese compounds.展开更多
A new strategy for the modification of cyclophosphamide was carried out and three series of new cyclophosphamide piperazinium salts 10,11 and 13 were prepared.These compounds,based on compound 9i scaffold,were evaluat...A new strategy for the modification of cyclophosphamide was carried out and three series of new cyclophosphamide piperazinium salts 10,11 and 13 were prepared.These compounds,based on compound 9i scaffold,were evaluated for their in vivo anticancer activities against hepatocyte sarcoma 22 （H 22）.The structure-activity relationship study reveals that 1） the conformation and the substituent at N-3 of cyclophosphamide spiropiperazinium salts 10 greatly affect the activity 2） different kinds of cyclophosphamide non-spiropiperazinium derivatives 11 show different activities 3） for 1,2-benzisoxazole phosphoropiperazinium salts 13,it is possible to obtain anticancer drug candidates with suitable quaternary ammonium moiety.These results would help to further design and synthesize analogs of mustard anticancer drugs.展开更多
To discover an efficient route for the shift from an antibacterial fluoroquinolone to an antitumor one based on the mechanistic similarities between targeting topoisomerases and the eukaryotic ones,two series of the t...To discover an efficient route for the shift from an antibacterial fluoroquinolone to an antitumor one based on the mechanistic similarities between targeting topoisomerases and the eukaryotic ones,two series of the title compounds,C3 bis-oxadiazole methylsulfides 6a―6h and corresponding dimethylpiperazinium iodides 7a―7h derived from levofloxacin 1 were designed and synthesized.Their in vitro antiproliferative activities against Chinese hamster ovary cell line（CHO）,murine leukemia cell line（L1210） and human leukocytoma cell line（HL60） were evaluated by MTT assay,and inhibitory effect on DNA topoisomerase IIα was also measured by means of densitometric assay.展开更多
The title compound (C4N2H12)2Zr(C2O4)4稨2O 1 was synthesized by the reaction of ZrOCl28H2O, H2C2O42H2O and piperazinium in aqueous solution. Single-crystal X-ray analysis has revealed that compound 1 (C16H26N4O17Zr, M...The title compound (C4N2H12)2Zr(C2O4)4稨2O 1 was synthesized by the reaction of ZrOCl28H2O, H2C2O42H2O and piperazinium in aqueous solution. Single-crystal X-ray analysis has revealed that compound 1 (C16H26N4O17Zr, Mr = 637.63) crystallizes in the monoclinic system, space group P21/c with a = 9.0425(3), b = 13.3844(3), c = 19.1191(5) ? ?= 98.365(1)o, V = 2289.34(11) ?, Z = 4, Dc = 1.850 g/cm3, F(000) = 1304, ?= 0.577 mm-1, the final R = 0.0240 and wR = 0.0628 for 4386 observed reflections with I > 2s(I). X-ray crystal-structure analysis suggests that compound 1 consists of [Zr(C2O4)4]4- anion and two protonated piperazinium cations. The anions are linked through hydrogen bonds of piperazinium. FT-IR and Raman spectra clearly show the existence of oxalate groups in the crystal lattice.展开更多
文摘A new piperazinium 4-nitro phenolate monohydrate single crystal(PNP)was grown by employing the solution growth technique piperazine and 4-nitrophenol,were the source material used for the growth,acetonitrile is used as solvent.The grown crystal was characterized by Single X-ray analysis and it shows that piperazinium 4-nitrophenol monohydrate crystallizes in the monoclinic space group P2 1/c,with cell parameters a=10.902 5(4),b=6.226 1(3),c=14.031 8(5),and z=4.The lattice parameters of the substances were also determined by using powder diffraction methods.The functional groups are identified by using FTIR spectral analysis.The absorbance of title compound were analyzed using UV-Vis spectra.The thermo analytical properties of the crystal were studied using TG,DTA.
文摘Electron impact ionization mass spectra of six new synthetic bis-piperazinium salts (M2+ 2Br-2HC1) with anti-tumor activities were obtained. Although the M+ ions and double charge ions M2+ were notobserved in E1 mass spectra, some strange ions such as [M-2]+ ions,[M-R]+ ions , [M-R-l]+ ions, [M-2R]+ ions and even [RX]+ ions presented in EIMS by decreasing the electron energy. These phenomena may be explained as R+ rearrangement and intermolecular reaction occurring in the condensed phase. We tried to describe the main routes of fragmentation and high sensitive mass spectra of the fragments oaboutthese compounds.
基金Foundation items:National Nature Science Foundation of China (Grant No. 20472008)the Major State Basic Research Development Program (Grant No. 2004CB719900)
文摘A new strategy for the modification of cyclophosphamide was carried out and three series of new cyclophosphamide piperazinium salts 10,11 and 13 were prepared.These compounds,based on compound 9i scaffold,were evaluated for their in vivo anticancer activities against hepatocyte sarcoma 22 （H 22）.The structure-activity relationship study reveals that 1） the conformation and the substituent at N-3 of cyclophosphamide spiropiperazinium salts 10 greatly affect the activity 2） different kinds of cyclophosphamide non-spiropiperazinium derivatives 11 show different activities 3） for 1,2-benzisoxazole phosphoropiperazinium salts 13,it is possible to obtain anticancer drug candidates with suitable quaternary ammonium moiety.These results would help to further design and synthesize analogs of mustard anticancer drugs.
基金Supported by the National Natural Science Foundation of China(Nos.20872028,21072045)
文摘To discover an efficient route for the shift from an antibacterial fluoroquinolone to an antitumor one based on the mechanistic similarities between targeting topoisomerases and the eukaryotic ones,two series of the title compounds,C3 bis-oxadiazole methylsulfides 6a―6h and corresponding dimethylpiperazinium iodides 7a―7h derived from levofloxacin 1 were designed and synthesized.Their in vitro antiproliferative activities against Chinese hamster ovary cell line（CHO）,murine leukemia cell line（L1210） and human leukocytoma cell line（HL60） were evaluated by MTT assay,and inhibitory effect on DNA topoisomerase IIα was also measured by means of densitometric assay.
基金This work was supported by the Natural Science Foundation of Fujian Province (No. E0110013 and K02028) and the State Key Laboratory of Structural Chemistry
文摘The title compound (C4N2H12)2Zr(C2O4)4稨2O 1 was synthesized by the reaction of ZrOCl28H2O, H2C2O42H2O and piperazinium in aqueous solution. Single-crystal X-ray analysis has revealed that compound 1 (C16H26N4O17Zr, Mr = 637.63) crystallizes in the monoclinic system, space group P21/c with a = 9.0425(3), b = 13.3844(3), c = 19.1191(5) ? ?= 98.365(1)o, V = 2289.34(11) ?, Z = 4, Dc = 1.850 g/cm3, F(000) = 1304, ?= 0.577 mm-1, the final R = 0.0240 and wR = 0.0628 for 4386 observed reflections with I > 2s(I). X-ray crystal-structure analysis suggests that compound 1 consists of [Zr(C2O4)4]4- anion and two protonated piperazinium cations. The anions are linked through hydrogen bonds of piperazinium. FT-IR and Raman spectra clearly show the existence of oxalate groups in the crystal lattice.
