4,6-dimethylquinoline-2-selenol | 1315483-69-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 4,6-dimethylquinoline-2-selenol
• CAS: 1315483-69-2
• 化学式: C₁₁H₁₁NSe
• 分子量: 236.175
• InChiKey: ZFJXQJVWWVPSOS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.38
• 重原子数：
  13.0
• 可旋转键数：
  0.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  12.89
• 氢给体数：
  0.0
• 氢受体数：
  1.0

反应信息

• 作为反应物：
  描述：

  4,6-dimethylquinoline-2-selenol 、 氯乙酸 在 sodium acetate 作用下， 以 乙醇 为溶剂， 反应 1.0h， 以50%的产率得到(4,6-dimethylquinolin-2-yl)selenoglycolic acid
  参考文献：
  名称：

  One Pot Synthesis of Some New Heteroylselenoglycolic Acids and Their Biological Activity

  摘要：

  A convenient one pot three-stage synthesis was used for obtaining new heteroylselenoglycolic and di-heteroylselenoglycolic acids by nucleophilic substitution reaction of the starting compounds pyridineselenol, pyridazineselenol, and quinolineselenol with -chloro- or ,-dichloroacetic acids for 1-h stirring. The newly synthesized compounds were screened biologically for anti-microbial and anti-oxidant activities. The structure of all new compounds was confirmed by H-1 NMR, C-13 NMR, Mass, and IR spectroscopy and elemental analyses.

  DOI：

  10.1080/10426507.2012.717138
• 作为产物：
  描述：

  2-氯-4,6-二甲基喹啉 在 selenium 、 sodium tetrahydroborate 作用下， 以 甲醇 为溶剂， 反应 2.0h， 生成 4,6-dimethylquinoline-2-selenol
  参考文献：
  名称：

  One Pot Synthesis of Some New Heteroylselenoglycolic Acids and Their Biological Activity

  摘要：

  A convenient one pot three-stage synthesis was used for obtaining new heteroylselenoglycolic and di-heteroylselenoglycolic acids by nucleophilic substitution reaction of the starting compounds pyridineselenol, pyridazineselenol, and quinolineselenol with -chloro- or ,-dichloroacetic acids for 1-h stirring. The newly synthesized compounds were screened biologically for anti-microbial and anti-oxidant activities. The structure of all new compounds was confirmed by H-1 NMR, C-13 NMR, Mass, and IR spectroscopy and elemental analyses.

  DOI：

  10.1080/10426507.2012.717138

文献信息

• Synthesis of selenium-containing amino acid analogues and their biological study
  作者：Sh. H. Abdel-Hafez、H. A. Saad、M. R. E. Aly

  DOI：10.1134/s1068162011030034

  日期：2011.5

  Synthesis of selenium-containing amino acid analogues is described. These compounds were prepared in a concise and short synthetic route in good yields by nucleophilic substitution reaction of pyridineselenol and quinolineselenol derivatives with N-phthaloylglycyl chloride followed by hydrazinolysis. The newly synthesized compounds were screened against different strains of bacteria and fungi.

  描述了含硒氨基酸类似物的合成。这些化合物是通过吡啶硒醇和喹啉硒醇衍生物与 N-邻苯二甲酰甘氨酰氯的亲核取代反应，然后进行肼解，以简洁和短的合成路线以良好的收率制备的。新合成的化合物针对不同的细菌和真菌菌株进行了筛选。