9,10-dimethyl-6-(p-tolyl)benzo[4,5]imidazo[2,1-a]isoquinoline | 1417819-33-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 9,10-dimethyl-6-(p-tolyl)benzo[4,5]imidazo[2,1-a]isoquinoline
• 英文别名: 9,10-Dimethyl-6-(4-methylphenyl)benzimidazolo[2,1-a]isoquinoline；9,10-dimethyl-6-(4-methylphenyl)benzimidazolo[2,1-a]isoquinoline
• CAS: 1417819-33-0
• 化学式: C₂₄H₂₀N₂
• 分子量: 336.436
• InChiKey: HHHAWQPICYBLSH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.2
• 重原子数：
  26
• 可旋转键数：
  1
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  17.3
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  在 palladium diacetate 、 三环己基膦 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 20.0h， 以43 mg的产率得到9,10-dimethyl-6-(p-tolyl)benzo[4,5]imidazo[2,1-a]isoquinoline
  参考文献：
  名称：

  Nucleophilic Addition of Benzimidazoles to Alkynyl Bromides/Palladium-Catalyzed Intramolecular C–H Vinylation: Synthesis of Benzo[4,5]imidazo[2,1-a]isoquinolines

  摘要：

  An efficient "one-pot" route for the synthesis of benzo[4,5]imidazo[2,1-a] isoquinolines has been developed via nucleophilic addition of 2-aryl benzimidazoles to alkynyl bromides and subsequent palladium-catalyzed intramolecular C-H vinylation.

  DOI：

  10.1021/jo302471z

文献信息

• <i>In situ</i> air oxidation and photophysical studies of isoquinoline-fused N-heteroacenes
  作者：Amol D. Sonawane、Rohini A. Sonawane、Khin Myat Noe Win、Masayuki Ninomiya、Mamoru Koketsu

  DOI：10.1039/d0ob00375a

  日期：——

  An efficient, metal free and environment friendly synthesis of isoquinoline-fused benzimidazoles has been developed via in situ air oxidation.

  已开发出一种高效、无金属、环境友好的合成方法，通过原位空气氧化制备异喹啉-融合苯并咪唑。
• Nucleophilic Addition of Benzimidazoles to Alkynyl Bromides/Palladium-Catalyzed Intramolecular C–H Vinylation: Synthesis of Benzo[4,5]imidazo[2,1-<i>a</i>]isoquinolines
  作者：Jinsong Peng、Guoning Shang、Chunxia Chen、Zhongshuo Miao、Bin Li

  DOI：10.1021/jo302471z

  日期：2013.2.1

  An efficient "one-pot" route for the synthesis of benzo[4,5]imidazo[2,1-a] isoquinolines has been developed via nucleophilic addition of 2-aryl benzimidazoles to alkynyl bromides and subsequent palladium-catalyzed intramolecular C-H vinylation.