(RS) (E) 2-trifluoroacetyl-1,2,3,4-tetrahydro-6,7-dimethoxy-1-[4',5'-dimethoxy-2'-(3''-trifluoroacetyl-1''-propenyl)phenyl]methylisoquinoline | 1185180-07-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异喹啉及其衍生物
• 英文名称: (RS) (E) 2-trifluoroacetyl-1,2,3,4-tetrahydro-6,7-dimethoxy-1-[4',5'-dimethoxy-2'-(3''-trifluoroacetyl-1''-propenyl)phenyl]methylisoquinoline
• 英文别名: (RS) (E) 2-trifluoroacetyl-1,2,3,4-tetrahydro-6,7-dimethoxy-1-[4',5'-dimethoxy-2'-(3"-trifluoroacetyl-1"-propenyl)phenyl]methylisoquinoline
• CAS: 1185180-07-7
• 化学式: C₂₇H₂₈F₆N₂O₆
• 分子量: 590.52
• InChiKey: JAPKHZKHJKHBPL-AATRIKPKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.64
• 重原子数：
  41.0
• 可旋转键数：
  9.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  86.33
• 氢给体数：
  1.0
• 氢受体数：
  6.0

反应信息

• 作为产物：
  描述：

  N-烯丙基-2,2,2-三氟乙酰胺 、 1-(2'-ethenyl-4',5'-dimethoxyphenyl)methyl-2-(trifluoroacetyl)-1,2,3,4-tetrahydro-6,7-dimethoxyisoquinoline 在 Grubbs catalyst first generation 作用下， 以 二氯甲烷 为溶剂， 反应 48.0h， 以30%的产率得到(RS) (E) 2-trifluoroacetyl-1,2,3,4-tetrahydro-6,7-dimethoxy-1-[4',5'-dimethoxy-2'-(3''-trifluoroacetyl-1''-propenyl)phenyl]methylisoquinoline
  参考文献：
  名称：

  The synthesis of carbon-linked bisbenzylisoquinolines via ruthenium-mediated olefin-metathesis

  摘要：

  Novel laudanosine dinners in which two laudanosine units are linked at C-2' via a two and four-carbon linker have been prepared using ruthenium-mediated olefin-metathesis. In addition, a second four-carbon linker between the two isoquinoline N-atoms was also present leading to a novel macrocyclic ring system. Five of these compounds showed higher cytostatic activity on three cancer cell lines than thalicarpine. Crown Copyright (C) 2009 Published by Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2009.05.094