2-Propen-1-one, 3-(3-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)- | 819792-78-4

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 直链 1,3-二芳基丙烷
• 英文名称: 2-Propen-1-one, 3-(3-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-
• 英文别名: 3-(3-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
• CAS: 819792-78-4
• 化学式: C₁₉H₂₀O₅
• 分子量: 328.365
• InChiKey: JMTGUGXQVBQMIV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  24
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  54
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  2-Propen-1-one, 3-(3-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)- 在 三氟乙酸 作用下， 反应 4.0h， 以48%的产率得到4,5,6-Trimethoxy-3-(3-methoxyphenyl)-2,3-dihydroinden-1-one
  参考文献：
  名称：

  Gallic acid-based indanone derivatives as anticancer agents

  摘要：

  Gallic acid-based indanone derivatives have been synthesised. Some of the indanones showed very good anticancer activity in MTT assay. Compounds 10, 11, 12 and 14 possessed potent anticancer activity against various human cancer cell lines. The most potent indanone (10, IC50 = 2.2 mu M), against MCF-7, that is, hormone-dependent breast cancer cell line, showed no toxicity to human erythrocytes even at higher concentrations (100 mu g/ml, 258 mu M). While, indanones 11, 12 and 14 showed toxicities to erythrocytes at higher concentrations. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.06.039
• 作为产物：
  描述：

  3',4',5'-三甲氧基苯乙酮 、 3-甲氧基苯甲醛 在 sodium hydroxide 作用下， 以 甲醇 、 水 为溶剂， 生成 2-Propen-1-one, 3-(3-methoxyphenyl)-1-(3,4,5-trimethoxyphenyl)-
  参考文献：
  名称：

  Gallic acid-based indanone derivatives as anticancer agents

  摘要：

  Gallic acid-based indanone derivatives have been synthesised. Some of the indanones showed very good anticancer activity in MTT assay. Compounds 10, 11, 12 and 14 possessed potent anticancer activity against various human cancer cell lines. The most potent indanone (10, IC50 = 2.2 mu M), against MCF-7, that is, hormone-dependent breast cancer cell line, showed no toxicity to human erythrocytes even at higher concentrations (100 mu g/ml, 258 mu M). While, indanones 11, 12 and 14 showed toxicities to erythrocytes at higher concentrations. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.06.039

文献信息

• Gallic acid-based indanone derivatives as anticancer agents
  作者：Hari Om Saxena、Uzma Faridi、Suchita Srivastava、J.K. Kumar、M.P. Darokar、Suaib Luqman、C.S. Chanotiya、Vinay Krishna、Arvind S. Negi、S.P.S. Khanuja

  DOI：10.1016/j.bmcl.2008.06.039

  日期：2008.7

  Gallic acid-based indanone derivatives have been synthesised. Some of the indanones showed very good anticancer activity in MTT assay. Compounds 10, 11, 12 and 14 possessed potent anticancer activity against various human cancer cell lines. The most potent indanone (10, IC50 = 2.2 mu M), against MCF-7, that is, hormone-dependent breast cancer cell line, showed no toxicity to human erythrocytes even at higher concentrations (100 mu g/ml, 258 mu M). While, indanones 11, 12 and 14 showed toxicities to erythrocytes at higher concentrations. (C) 2008 Elsevier Ltd. All rights reserved.