(4-isopropyl-piperazin-1-yl)-isoquinolin-4-yl-methanone

• 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: (4-isopropyl-piperazin-1-yl)-isoquinolin-4-yl-methanone
• 英文别名: Isoquinolin-4-yl-(4-propan-2-ylpiperazin-1-yl)methanone；isoquinolin-4-yl-(4-propan-2-ylpiperazin-1-yl)methanone
• 化学式: C₁₇H₂₁N₃O
• 分子量: 283.373
• InChiKey: RGGYIHNECISOBT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  21
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  36.4
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  1-异丙基哌嗪 、 4-溴异喹啉 、 alkaline earth salt of/the/ methylsulfuric acid 在 trans-di(μ-acetato)bis[o-(di-o-tolylphosphino)benzyl]dipalladium(II) 1,8-二氮杂双环[5.4.0]十一碳-7-烯 、 tri tert-butylphosphoniumtetrafluoroborate 作用下， 以 四氢呋喃 为溶剂， 反应 0.1h， 以43%的产率得到(4-isopropyl-piperazin-1-yl)-isoquinolin-4-yl-methanone
  参考文献：
  名称：

  Microwave assisted, palladium catalyzed aminocarbonylations of heteroaromatic bromides using solid Mo(CO)6 as the carbon monoxide source

  摘要：

  The direct conversion of a variety of heteroaromatic bromides into heteroaromatic amides is described. This reaction utilizes Mo(CO)(6) as the carbon monoxide source and is performed using microwave heating allowing for very short reaction times. This convenient methodology allows for the preparation of a variety of heteroaromatic amides useful in medicinal chemistry applications. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2007.01.133

文献信息

• Microwave assisted, palladium catalyzed aminocarbonylations of heteroaromatic bromides using solid Mo(CO)6 as the carbon monoxide source
  作者：Michael A. Letavic、Kiev S. Ly

  DOI：10.1016/j.tetlet.2007.01.133

  日期：2007.3

  The direct conversion of a variety of heteroaromatic bromides into heteroaromatic amides is described. This reaction utilizes Mo(CO)(6) as the carbon monoxide source and is performed using microwave heating allowing for very short reaction times. This convenient methodology allows for the preparation of a variety of heteroaromatic amides useful in medicinal chemistry applications. (c) 2007 Elsevier Ltd. All rights reserved.