8-methyl-8-azabicyclo[3.2.1]octan-3-yl 1H-indole-3 carboxylate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: 8-methyl-8-azabicyclo[3.2.1]octan-3-yl 1H-indole-3 carboxylate
• 英文别名: [(1S,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 1H-indole-3-carboxylate
• 化学式: C₁₇H₂₀N₂O₂
• 分子量: 284.358
• InChiKey: ZNRGQMMCGHDTEI-RYUDHWBXSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  21
• 可旋转键数：
  3
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  45.3
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  乙酸酐 、 8-methyl-8-azabicyclo[3.2.1]octan-3-yl 1H-indole-3 carboxylate 在 4-二甲氨基吡啶 、 三乙胺 作用下， 以 1,2-二氯乙烷 为溶剂， 以43.8 %的产率得到8-methyl-8-azabicyclo[3.2.1]octan-3-yl 1-acetyl-1H-indole-3-carboxylate
  参考文献：
  名称：

  通过光诱导加氢羧化将平面杂环转化为三维类似物**

  摘要：

  我们报告了一种新策略，通过脱芳烃加氢羧化将吲哚和相关杂环化合物转化为多种 3D 类似物。该转化具有高度化学选择性、范围广泛、操作简单且易于进行高通量实验（HTE）。

  DOI：

  10.1002/anie.202303264

文献信息

• METHOD AND COMPOSITION FOR TREATING ALZHEIMER-TYPE DEMENTIA
  申请人：Chase Pharmaceuticals Corporation

  公开号：US20160143890A1

  公开（公告）日：2016-05-26

  There is described a method for increasing the maximal tolerated dose and thus the efficacy of an acetyl choline esterase inhibitor (AChEI) in a patient suffering from an Alzheimer type dementia by decreasing concomitant adverse effects by administration of said AChEI in combination with a non-anticholinergic antiemetic agent, whereby an enhanced acetyl choline esterase inhibition in the CNS of said patient is achieved and alleviation of the symptoms of Alzheimer type dementia in said patient is thereby improved to a greater extent. The use of a non-anticholinergic antiemetic agent for the preparation of a pharmaceutical composition for the treatment of Alzheimer type dementia in combination with an acetyl choline esterase inhibitor (AChEI) and pharmaceutical compositions comprising (a) a 5HT 3 receptor antagonist, a dopamine antagonist, a H1-receptor antagonist, a cannabinoid agonist, aprepitant or casopitant as an antiemetic agent and (b) an acetylcholine esterase inhibitor are also described.
• US9744161B2
  申请人：——

  公开号：US9744161B2

  公开（公告）日：2017-08-29
• US9943508B2
  申请人：——

  公开号：US9943508B2

  公开（公告）日：2018-04-17
• Translating Planar Heterocycles into Three‐Dimensional Analogs by Photoinduced Hydrocarboxylation**
  作者：Myriam Mikhael、Sara N. Alektiar、Charles S. Yeung、Zachary K. Wickens

  DOI：10.1002/anie.202303264

  日期：2023.7.24

  We report a new strategy that translates indoles and related heterocycles into diverse 3D analogs by dearomative hydrocarboxylation. The transformation is highly chemoselective, broad in scope, operationally simple, and readily amenable to high-throughput experimentation (HTE).

  我们报告了一种新策略，通过脱芳烃加氢羧化将吲哚和相关杂环化合物转化为多种 3D 类似物。该转化具有高度化学选择性、范围广泛、操作简单且易于进行高通量实验（HTE）。