4-[4-(4-Hydroxybut-2-ynylsulfanyl)quinolin-3-yl]sulfanylbut-2-yn-1-ol | 1076231-17-8

• 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: 4-[4-(4-Hydroxybut-2-ynylsulfanyl)quinolin-3-yl]sulfanylbut-2-yn-1-ol
• CAS: 1076231-17-8
• 化学式: C₁₇H₁₅NO₂S₂
• 分子量: 329.444
• InChiKey: MTMJANUOYZUQSL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  22
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  104
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  4-bromobut-2-yn-1-ol 、 4-Chloro-3-(4-hydroxy-2-butynylthio)quinoline 在 硫脲 、 sodium hydroxide 作用下， 以 乙醇 、 水 为溶剂， 反应 1.25h， 以58%的产率得到4-[4-(4-Hydroxybut-2-ynylsulfanyl)quinolin-3-yl]sulfanylbut-2-yn-1-ol
  参考文献：
  名称：

  Synthesis and antiproliferative activity in vitro of novel (2-butynyl)thioquinolines

  摘要：

  The series of new acetylenic thioquinolines containing propargyl, 2-butynyl, 4-bromo-2-butynyl, and 4-hydroxy- 2-butynyl groups has been prepared and tested for antiproliferative activity in vitro against human [SW707 ( colorectal adenocarcinoma), CCRF/CEM ( leukemia)] and murine [P388 ( leukemia), B16 ( melanoma)] cancer lines. All the compounds obtained exhibited antiproliferative activity. The most active compounds 7, 16, 17, and 19 have the ID(50) values ranging from 0.2 to 4.6 mu g/ml comparable to that of cisplatin used as referencecompounds. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2008.07.047

文献信息

• Synthesis and antiproliferative activity in vitro of novel (2-butynyl)thioquinolines
  作者：W. Mól、M. Matyja、B. Filip、J. Wietrzyk、S. Boryczka

  DOI：10.1016/j.bmc.2008.07.047

  日期：2008.9

  The series of new acetylenic thioquinolines containing propargyl, 2-butynyl, 4-bromo-2-butynyl, and 4-hydroxy- 2-butynyl groups has been prepared and tested for antiproliferative activity in vitro against human [SW707 ( colorectal adenocarcinoma), CCRF/CEM ( leukemia)] and murine [P388 ( leukemia), B16 ( melanoma)] cancer lines. All the compounds obtained exhibited antiproliferative activity. The most active compounds 7, 16, 17, and 19 have the ID(50) values ranging from 0.2 to 4.6 mu g/ml comparable to that of cisplatin used as referencecompounds. (C) 2008 Elsevier Ltd. All rights reserved.