(3aS,4S,9bR)-4-(3-chlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid

• 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: (3aS,4S,9bR)-4-(3-chlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid
• 化学式: C₁₉H₁₆ClNO₂
• 分子量: 325.795
• InChiKey: JGVZQZYRGOFCJB-RVKKMQEKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  23
• 可旋转键数：
  2
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  49.3
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  在 三氟乙酸 作用下， 反应 2.0h， 生成 (3aS,4S,9bR)-4-(3-chlorophenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid
  参考文献：
  名称：

  Structure–activity relationship (SAR) investigations of tetrahydroquinolines as BKCa agonists

  摘要：

  The membrane bound large-conductance, calcium-activated potassium channel (BKCa) is an important regulator of neuronal activity. Here we describe the identification and structure-activity relationship of a novel class of potent tetrahydroquinoline BKCa agonists. An example from this class of BKCa agonists was shown to depress the spontaneous neuronal discharges in an electrophysiological model of migraine. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.04.125

文献信息

• Structure–activity relationship (SAR) investigations of tetrahydroquinolines as BKCa agonists
  作者：Vijay K. Gore、Vu V. Ma、Ruoyuan Yin、Joe Ligutti、David Immke、Elizabeth M. Doherty、Mark H. Norman

  DOI：10.1016/j.bmcl.2010.04.125

  日期：2010.6

  The membrane bound large-conductance, calcium-activated potassium channel (BKCa) is an important regulator of neuronal activity. Here we describe the identification and structure-activity relationship of a novel class of potent tetrahydroquinoline BKCa agonists. An example from this class of BKCa agonists was shown to depress the spontaneous neuronal discharges in an electrophysiological model of migraine. (C) 2010 Elsevier Ltd. All rights reserved.