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Synthesis,Crystal Structure and Antitumor Activity in Vitro of a New Benzoate Binuclear Cupper( Ⅱ) Complex
引用本文:康杰,黄细河,许建华,蒋智清,黄长沧.Synthesis,Crystal Structure and Antitumor Activity in Vitro of a New Benzoate Binuclear Cupper( Ⅱ) Complex[J].结构化学,2009,28(1):15-18.
作者姓名:康杰  黄细河  许建华  蒋智清  黄长沧
作者单位:KANG Jie(Department of Chemistry,Fuzhou University,Fudwu,Fujian 350002,China;College of Pharmacy,Fujian Medical University,Fuzhou,Fujian 350004,China);HUANG Xi-He,HUANG Chang-Cang(Department of Chemistry,Fuzhou University,Fudwu,Fujian 350002,China);XU Jian-Hua,JIANG Zhi-Qing(College of Pharmacy,Fujian Medical University,Fuzhou,Fujian 350004,China)  
基金项目:福建省自然科学基金,DAпCHI PHARMACEUTICAL(BEIJING)CO.
摘    要:The title compound, Cu2(C7H5O2)4(C2H6O)2], was synthesized by the reaction of benzoic acid, copper acetate and ethanol in an aqueous solution. Trypan blue dye exclusion method was used in experiment. X-ray single-crystal analysis has revealed that compound 1 (C32H32Cu2O10) crystallizes in the monoclinic system, space group C2/c, Mr = 703.66, a = 47.340(5), b = 6.6613(4), c = 22.028(2)A,β = 113.284(4)°, V = 6380.6(10) A^3, Z = 8, Dc= 1.465 g/cm^3, F(000) = 2896,μ = 1.388 mm^-11, the final R = 0.0515 and wR = 0.1172 for 5712 observed reflections with I 〉 2σ(I). X-ray crystal structure analysis suggests that compound CH2(C7H5O2)4(C2H6O)2] has a binuclear structure with two Cu(II) atoms coordinated by four benzoate groups and two ethanol molecules. The crystal packing is stabilized by intermolecular O-H...O hydrogen bonds. The compound inhibits the proliferation of K562 cells (chronic myeloid leukemic cells) significantly and dose-dependently in 48 h, and IC50 of K562 is 17.3μg/mL by trypan blue dye exclusion method.

关 键 词:双核铜(Ⅱ)配位化合物  晶体结构  合成  安息香酸盐  抗癌活性

Synthesis,Crystal Structure and Antitumor Activity in Vitro of a New Benzoate Binuclear CupperⅡ)Complex
KANG Jie,HUANG Xi-He,XU Jian-Hua,JIANG Zhi-Qing,HUANG Chang-Cang.Synthesis,Crystal Structure and Antitumor Activity in Vitro of a New Benzoate Binuclear CupperⅡ)Complex[J].Chinese Journal of Structural Chemistry,2009,28(1):15-18.
Authors:KANG Jie  HUANG Xi-He  XU Jian-Hua  JIANG Zhi-Qing  HUANG Chang-Cang
Institution:1. Department of Chemistry,Fuzhou University,Fudwu,Fujian 350002,China;College of Pharmacy,Fujian Medical University,Fuzhou,Fujian 350004,China
2. Department of Chemistry,Fuzhou University,Fudwu,Fujian 350002,China
3. College of Pharmacy,Fujian Medical University,Fuzhou,Fujian 350004,China
Abstract:The title compound,Cu2(C7H5O2)4(C2H6O)2],was synthesized by the reaction of benzoic acid,copper acetate and ethanol in an aqueous solution.Trypan blue dye exclusion method was used in experiment.X-ray single-crystal analysis has revealed that compound 1 (C32H32Cu2O10)crystallizes in the monoclinic system,space group C2/c,Mr=703.66,a=47.340(5),b=6.6613(4),C=22.028(2)(A),β=113.284(4)°,V=6380.6(10)(A)3,Z=8,Dc=1.465 g/cm3,F(000)=2896,μ=1.388 mm-1,the final R=0.0515 and wR=O.1172 for 5712 observed reflections with I>2σ(I).X-ray crystal structure analysis suggests that compound Cu2C7H5Oz]4(C2H6O)2]has a binuclear structure with two Cu(п)atoms coordinated by four benzoate groups and two ethanol molecules.The crystal packing is stabilized by intermolecular O-H-O hydrogen bonds.The compound inhibits the proliferation of K562 cells(chronic myeloid leukemic cells)significantly and dose-dependently in 48 h,and IC50 of K562 is 17.μg/mL by trypan blue dye exclusion method.
Keywords:crystal structure  benzoate  antitumor activity  K562
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