4-Chloro-N-{2-[2-hydroxy-3-(naphthalen-1-yloxy)-propylamino]-ethyl}-3-sulfamoyl-benzamide | 136291-89-9

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 4-Chloro-N-{2-[2-hydroxy-3-(naphthalen-1-yloxy)-propylamino]-ethyl}-3-sulfamoyl-benzamide
• 英文别名: 4-chloro-N-[2-[(2-hydroxy-3-naphthalen-1-yloxypropyl)amino]ethyl]-3-sulfamoylbenzamide
• CAS: 136291-89-9
• 化学式: C₂₂H₂₄ClN₃O₅S
• 分子量: 477.969
• InChiKey: PEIOQWQTVIFJQV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  32
• 可旋转键数：
  10
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  139
• 氢给体数：
  4
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  methyl 4-chloro-3-sulfamoylbenzoate 以 乙醇 为溶剂， 反应 19.0h， 生成 4-Chloro-N-{2-[2-hydroxy-3-(naphthalen-1-yloxy)-propylamino]-ethyl}-3-sulfamoyl-benzamide
  参考文献：
  名称：

  Symbiotic approach to drug design: N-[(4-chloro-3-sulfamoylbenzamido)-ethyl]propanolamine derivatives as β-adrenergic blocking agents with diuretic activity

  摘要：

  A series of oxypropanolamines and iminoxypropanolamines, in which the aminic substituent was the 2-(4-chloro-3-sulfamoylbenzamido)-ethyl group, were synthesized as potential beta-blocker/diuretic agents. All of these compounds were tested for beta-1-adrenoceptor affinity and beta-blocking potency. For the most active compounds, diuretic and antihypertensive properties as well as affinity for alpha-1-adrenoceptors were also investigated. Compounds 4 and 10 were found to display contemporaneously beta-blocking, diuretic and antihypertensive activities.

  DOI：

  10.1016/0223-5234(91)90098-8