1-<(tert-butyldioxy)methyl>-4-phenylpiperazine | 116437-27-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: 1-<(tert-butyldioxy)methyl>-4-phenylpiperazine
• 英文别名: 1-[(tert-butyldioxy)methyl]-4-phenylpiperazine；1-(Tert-butylperoxymethyl)-4-phenylpiperazine
• CAS: 116437-27-5
• 化学式: C₁₅H₂₄N₂O₂
• 分子量: 264.368
• InChiKey: IHXBQGVZVSBBCR-UHFFFAOYSA-N

物化性质

• 沸点：
  339.9±37.0 °C(Predicted)
• 密度：
  1.046±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  19
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  24.9
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  叔丁基过氧化氢 、 聚合甲醛 、 N-苯基哌嗪 以 甲醇 、 水 为溶剂， 反应 1.0h， 以95%的产率得到1-<(tert-butyldioxy)methyl>-4-phenylpiperazine
  参考文献：
  名称：

  Amine peroxides as potential antimalarials

  摘要：

  Six model amine peroxides (4-9) were synthesized as targeted antimalarial oxidants. They were approximately 1 order of magnitude more potent than tert-butyl hydroperoxide (3) in vitro against Plasmodium falciparum, but like 3, they were inactive in vivo against Plasmodium berghei.

  DOI：

  10.1021/jm00121a013

文献信息

• Amine peroxides as potential antimalarials
  作者：Jonathan L. Vennerstrom

  DOI：10.1021/jm00121a013

  日期：1989.1

  Six model amine peroxides (4-9) were synthesized as targeted antimalarial oxidants. They were approximately 1 order of magnitude more potent than tert-butyl hydroperoxide (3) in vitro against Plasmodium falciparum, but like 3, they were inactive in vivo against Plasmodium berghei.