benzofuro-2-carboxy-[4'-bromophenyl] thiosemicarbazide | 850310-54-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并呋喃
• 英文名称: benzofuro-2-carboxy-[4'-bromophenyl] thiosemicarbazide
• 英文别名: 1-(1-Benzofuran-2-carbonylamino)-3-(4-bromophenyl)thiourea
• CAS: 850310-54-2
• 化学式: C₁₆H₁₂BrN₃O₂S
• 分子量: 390.26
• InChiKey: WGRVGMTZQQBVPR-UHFFFAOYSA-N

物化性质

• 密度：
  1.622±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  23
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  98.4
• 氢给体数：
  3
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  benzofuro-2-carboxy-[4'-bromophenyl] thiosemicarbazide 、 cadmium(II) chloride 在 sodium acetate 作用下， 以 乙醇 为溶剂， 以78%的产率得到[CdCl2(benzofuro-2-carboxy-[4'-bromophenyl] thiosemicarbazide)](n)
  参考文献：
  名称：

  Synthesis, Spectral Studies, and Biological Activity of Metal Complexes of Benzofuran Thiosemicarbazides

  摘要：

  The complexes of Co(II), Cu(II), Ni(II), Cd(II), Hg(II), Zn(II), UO2(VI), and Th(IV) with benzofuran thiosemicarbazides have been prepared. All complexes have the general formula MLXn, where n = 2 or 4, X = Cl or NO3 and L is the ligand prepared by the reaction of benzofuran-2-carboxyhydrazide with p-methyl, p-methoxy, or p-bromophenylisothiocyanate. The complexes were characterized on the basis of elemental analyses, spectral, magnetic moment, and conductance studies. The ligands coordinate to the metal ions through the oxygen of the arbonyl group and the nitrogen of the hydrazine group. We have assigned the probable geometry for all of these complexes based on their physico-chemical data. All the metal complexes and ligands were screened for their anti-microbial activity.

  DOI：

  10.1081/sim-200030199

文献信息

• Synthesis, Spectral Studies, and Biological Activity of Metal Complexes of Benzofuran Thiosemicarbazides
  作者：M. B. Halli、Shashidhar、Z. S. Qureshi

  DOI：10.1081/sim-200030199

  日期：2004.12

  The complexes of Co(II), Cu(II), Ni(II), Cd(II), Hg(II), Zn(II), UO2(VI), and Th(IV) with benzofuran thiosemicarbazides have been prepared. All complexes have the general formula MLXn, where n = 2 or 4, X = Cl or NO3 and L is the ligand prepared by the reaction of benzofuran-2-carboxyhydrazide with p-methyl, p-methoxy, or p-bromophenylisothiocyanate. The complexes were characterized on the basis of elemental analyses, spectral, magnetic moment, and conductance studies. The ligands coordinate to the metal ions through the oxygen of the arbonyl group and the nitrogen of the hydrazine group. We have assigned the probable geometry for all of these complexes based on their physico-chemical data. All the metal complexes and ligands were screened for their anti-microbial activity.