N-benzyl-N-methyl-(1,2,3,5,6,7-hexahydro-1,5:3,7-dimethano-4-benzoxonin-3-yl)amine | 1207834-36-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: N-benzyl-N-methyl-(1,2,3,5,6,7-hexahydro-1,5:3,7-dimethano-4-benzoxonin-3-yl)amine
• 英文别名: N-benzyl-N-methyl-11-oxatetracyclo[8.3.1.18,12.02,7]pentadeca-2,4,6-trien-10-amine
• CAS: 1207834-36-3
• 化学式: C₂₂H₂₅NO
• 分子量: 319.447
• InChiKey: KAKVRZUWLJNVOD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  24
• 可旋转键数：
  3
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  12.5
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  N-benzyl-N-methyl-(1,2,3,5,6,7-hexahydro-1,5:3,7-dimethano-4-benzoxonin-3-yl)amine 在 盐酸 作用下， 以 乙醚 、 乙酸乙酯 为溶剂， 生成 N-benzyl-N-methyl-(1,2,3,5,6,7-hexahydro-1,5:3,7-dimethano-4-benzoxonin-3-yl)amine hydrochloride
  参考文献：
  名称：

  New oxapolycyclic cage amines with NMDA receptor antagonist and trypanocidal activities

  摘要：

  The synthesis of several (1,2,3,5,6,7-hexahydro-1,5: 3,7-dimethano-4-benzoxonin-3-yl)amines and related compounds is reported. Several of them display very similar activity to memantine as NMDA receptor antagonists. Several derivatives showed a significant level of trypanocidal activity. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2009.11.017
• 作为产物：
  描述：

  聚合甲醛 、 N-benzyl-(1,2,3,5,6,7-hexahydro-1,5:3,7-dimethano-4-benzoxonin-3-yl)amine hydrochloride 在 sodium cyanoborohydride 、 溶剂黄146 、 sodium hydroxide 作用下， 以 水 、 乙腈 为溶剂， 反应 4.5h， 以91%的产率得到N-benzyl-N-methyl-(1,2,3,5,6,7-hexahydro-1,5:3,7-dimethano-4-benzoxonin-3-yl)amine
  参考文献：
  名称：

  New oxapolycyclic cage amines with NMDA receptor antagonist and trypanocidal activities

  摘要：

  The synthesis of several (1,2,3,5,6,7-hexahydro-1,5: 3,7-dimethano-4-benzoxonin-3-yl)amines and related compounds is reported. Several of them display very similar activity to memantine as NMDA receptor antagonists. Several derivatives showed a significant level of trypanocidal activity. (C) 2009 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2009.11.017

文献信息

• New oxapolycyclic cage amines with NMDA receptor antagonist and trypanocidal activities
  作者：María D. Duque、Pelayo Camps、Eva Torres、Elena Valverde、Francesc X. Sureda、Marta López-Querol、Antoni Camins、S. Radhika Prathalingam、John M. Kelly、Santiago Vázquez

  DOI：10.1016/j.bmc.2009.11.017

  日期：2010.1

  The synthesis of several (1,2,3,5,6,7-hexahydro-1,5: 3,7-dimethano-4-benzoxonin-3-yl)amines and related compounds is reported. Several of them display very similar activity to memantine as NMDA receptor antagonists. Several derivatives showed a significant level of trypanocidal activity. (C) 2009 Elsevier Ltd. All rights reserved.