3-methyl-2-(methylthio)-4-phenylquinoline | 1561153-03-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 3-methyl-2-(methylthio)-4-phenylquinoline
• 英文别名: 3-Methyl-2-methylsulfanyl-4-phenylquinoline；3-methyl-2-methylsulfanyl-4-phenylquinoline
• CAS: 1561153-03-4
• 化学式: C₁₇H₁₅NS
• 分子量: 265.379
• InChiKey: YNHVWEWKURKERA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  38.2
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  3-methyl-2-(methylthio)-4-phenylquinoline 在 间氯过氧苯甲酸 作用下， 以 二氯甲烷 为溶剂， 反应 6.0h， 以60%的产率得到3-methyl-2-(methylsulfonyl)-4-phenylquinoline
  参考文献：
  名称：

  Alkyltriflate-Triggered Annulation of Arylisothiocyanates and Alkynes Leading to Multiply Substituted Quinolines through Domino Electrophilic Activation

  摘要：

  The reaction of arylisothiocyanate, alkyltriflate, and alkynes leads to variously substituted quinolines in high yields. The reaction undergoes alkyltriflate-triggered domino electrophilic activation and avoids the use of a transition-metal catalyst. A variety of functional groups are tolerated in the quinoline ring.

  DOI：

  10.1021/ol500221u
• 作为产物：
  描述：

  1-苯基-1-丙炔 、 硫代异氰酸苯酯 、 三氟甲烷磺酸甲酯 以 1,2-二氯乙烷 为溶剂， 反应 12.0h， 以72%的产率得到3-methyl-2-(methylthio)-4-phenylquinoline
  参考文献：
  名称：

  Alkyltriflate-Triggered Annulation of Arylisothiocyanates and Alkynes Leading to Multiply Substituted Quinolines through Domino Electrophilic Activation

  摘要：

  The reaction of arylisothiocyanate, alkyltriflate, and alkynes leads to variously substituted quinolines in high yields. The reaction undergoes alkyltriflate-triggered domino electrophilic activation and avoids the use of a transition-metal catalyst. A variety of functional groups are tolerated in the quinoline ring.

  DOI：

  10.1021/ol500221u

文献信息

• Alkyltriflate-Triggered Annulation of Arylisothiocyanates and Alkynes Leading to Multiply Substituted Quinolines through Domino Electrophilic Activation
  作者：Peng Zhao、Xiaoyu Yan、Hang Yin、Chanjuan Xi

  DOI：10.1021/ol500221u

  日期：2014.2.21

  The reaction of arylisothiocyanate, alkyltriflate, and alkynes leads to variously substituted quinolines in high yields. The reaction undergoes alkyltriflate-triggered domino electrophilic activation and avoids the use of a transition-metal catalyst. A variety of functional groups are tolerated in the quinoline ring.