1-methylquinoline-2(1H)-selenone | 110177-07-6

• 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: 1-methylquinoline-2(1H)-selenone
• 英文别名: 1-methyl-1H-quinoline-2-selone；1-Methyl-1H-chinolin-2-selon；1-Methylquinoline-2-selone；1-methylquinoline-2-selone
• CAS: 110177-07-6
• 化学式: C₁₀H₉NSe
• 分子量: 222.148
• InChiKey: YRDMEKFVUWTAOX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.88
• 重原子数：
  12
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  3.2
• 氢给体数：
  0
• 氢受体数：
  1

反应信息

• 作为产物：
  描述：

  1-甲基-2-喹啉酮 在 Woollins 试剂 作用下， 以 甲苯 为溶剂， 反应 4.0h， 以98%的产率得到1-methylquinoline-2(1H)-selenone
  参考文献：
  名称：

  Heterocoumarins Are Selective Carbonic Anhydrase IX and XII Inhibitors with Cytotoxic Effects against Cancer Cells Lines

  摘要：

  We have synthesized a new series of coumarin-based compounds demonstrating high selectivity and potent effects with low nanomolar affinity against the tumor associated carbonic anhydrase (CA, EC 4.2.1.1) isoforms hCA IX and XII. A number of these compounds were evaluated ex vivo against human prostate (PC3) and breast (MDA-MB-231) cancer cell lines. Compounds 4b and 15 revealed effective cytotoxic effects after 48 h of incubation in both normoxic and hypoxic conditions with PC3 cancer cell line. However, compound 3 showed selective cytotoxic effects against MDA-MB-231 in hypoxic condition. These results may be of particular importance for the choice of future drug candidates targeting hypoxic tumors and metastases, considering the fact that a selective carbonic anhydrase CA IX inhibitor (SLC-0111) is presently in phase II clinical trials.

  DOI：

  10.1021/acsmedchemlett.8b00362

文献信息

• Compounds containing sulphur chromophores. Part I. The action of bases on heterocyclic sulphide quarternary salts
  作者：Edward B. Knott

  DOI：10.1039/jr9550000916

  日期：——