| 1609451-64-0

• CAS: 1609451-64-0
• 化学式: C₁₀H₁₄ClCuN₃O₃S
• 分子量: 355.304
• InChiKey: GGPPQELEQCOCGG-BLSNBFPRSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为产物：
  描述：

  2-肼基苯并噻唑 以 甲醇 为溶剂， 反应 8.0h， 生成
  参考文献：
  名称：

  Synthesis, crystal structures and characterization of late first row transition metal complexes derived from benzothiazole core: Anti-tuberculosis activity and special emphasis on DNA binding and cleavage property

  摘要：

  Air and moisture stable coordination compounds of late first row transition metals, viz. Co(II), Ni(II), Cu(II) and Zn(II), with a newly designed ligand, 2-(2-benzo[d]thiazol-2-yl)hydrazono)propan-1-ol (LH), were prepared and successfully characterized using various spectra-analytical techniques. The molecular structures of the ligand and nickel complex were unambiguously determined by single-crystal X-ray diffraction method. The [Ni(LH)(2)]Cl-2 center dot 3H(2)O complex is stabilized by intermolecular CH center dot center dot center dot pi stacking interactions between the methyl hydrogen and the C18 atom of the phenyl ring (C11-H11B center dot center dot center dot C18) forming 1D zig-zag chain structure. Both, the ligand and its copper complex, were electrochemically active in the working potential range, showing quasi-reversible redox system. The interactions of all the compounds with calf thymus DNA have been comprehensively investigated using electronic absorption spectroscopy, viscosity, electrochemistry and thermal denaturation studies. The cleavage reaction on pBR322 DNA has been monitored by agarose gel electrophoresis. The results showed that the ligand can bind to CT-DNA through partial intercalation, whereas the complexes bind electrostatically. Further, [Ni(LH)(2)]Cl-2 center dot 3H(2)O and [CuLCl(H2O) (2)] complexes in the series have high binding and cleavage affinity towards pBR322 DNA. Additionally, all the compounds were screened for anti-tuberculosis activity. All the complexes revealed an MIC value of 0.8 mu g/mL, which is almost 8 times active than standard used (Streptomycin, 6.25 mu g/mL). (C) 2014 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2014.03.083