[4-[4-[2-(Diethylamino)ethyl]piperazine-1-carbonyl]phenyl] acetate | 773034-50-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚酯
• 英文名称: [4-[4-[2-(Diethylamino)ethyl]piperazine-1-carbonyl]phenyl] acetate
• CAS: 773034-50-7
• 化学式: C₁₉H₂₉N₃O₃
• 分子量: 347.458
• InChiKey: NMBYFYVANKYDCQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  25
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.58
• 拓扑面积：
  53.1
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  [4-[4-[2-(Diethylamino)ethyl]piperazine-1-carbonyl]phenyl] acetate 在 potassium carbonate 作用下， 以 甲醇 为溶剂， 反应 1.0h， 生成 [4-(2-Diethylamino-ethyl)-piperazin-1-yl]-(4-hydroxy-phenyl)-methanone
  参考文献：
  名称：

  Synthesis of 4-(4-guanidinobenzoyloxy)benzamides and 1-(4-guanidinobenzoyloxy)benzoyloxy acetamides as trypsin inhibitors

  摘要：

  Seventeen new compounds of 4-(4-guanidinobenzoyloxy)benzamides and 4-(4-guanidinobenzoyloxy)benzoyloxyacetamides were prepared and their inhibitory activities on trypsin, thrombin and porcine pancreatic elastase were measured. These compounds were found to be selective trypsin inhibitors with inhibiting activities from 0.44 to 43 mu M.

  DOI：

  10.1016/s0223-5234(97)89852-2
• 作为产物：
  描述：

  1-(2-二乙氨基乙基)哌嗪 、 4-乙酰氧基苯甲酸 在 草酰氯 、 三乙胺 作用下， 生成 [4-[4-[2-(Diethylamino)ethyl]piperazine-1-carbonyl]phenyl] acetate
  参考文献：
  名称：

  Synthesis of 4-(4-guanidinobenzoyloxy)benzamides and 1-(4-guanidinobenzoyloxy)benzoyloxy acetamides as trypsin inhibitors

  摘要：

  Seventeen new compounds of 4-(4-guanidinobenzoyloxy)benzamides and 4-(4-guanidinobenzoyloxy)benzoyloxyacetamides were prepared and their inhibitory activities on trypsin, thrombin and porcine pancreatic elastase were measured. These compounds were found to be selective trypsin inhibitors with inhibiting activities from 0.44 to 43 mu M.

  DOI：

  10.1016/s0223-5234(97)89852-2