1-(2,4-Difluorophenyl)-3-(4-methylphenyl)propane-1,3-dione | 1094372-03-8

• 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: 1-(2,4-Difluorophenyl)-3-(4-methylphenyl)propane-1,3-dione
• CAS: 1094372-03-8
• 化学式: C₁₆H₁₂F₂O₂
• 分子量: 274.267
• InChiKey: UBDTUEAEKXZKQM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  20
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  34.1
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2',4'-二氟苯乙酮 在 溴 、 potassium hydroxide 、 sodium hydroxide 作用下， 以 甲醇 、 乙醇 、 氯仿 、 水 为溶剂， 反应 3.0h， 生成 1-(2,4-Difluorophenyl)-3-(4-methylphenyl)propane-1,3-dione
  参考文献：
  名称：

  Synthesis and preliminary evaluation of difluorinated 1,3-propanediones as potential agents in the treatment of breast cancer

  摘要：

  A series of difluorinated propanediones were synthesized and evaluated for in vitro cytotoxic activity by Sulforhodamine B (SRB) assay against a panel of four human cancer cell lines. Though the compounds showed varying degrees of cytotoxicity in the tested cell lines, most marked effect was observed in breast cancer cell line (MCF7), wherein nine of the ten synthesized chalcones showed good antiproliferative activity.

  DOI：

  10.1007/s00044-011-9561-0

文献信息

• Synthesis and preliminary evaluation of difluorinated 1,3-propanediones as potential agents in the treatment of breast cancer
  作者：Tabreskhan Pathan、Sachin Ingale、Ashish Sharma、Rhea Mohan、C. S. Ramaa

  DOI：10.1007/s00044-011-9561-0

  日期：2012.5

  A series of difluorinated propanediones were synthesized and evaluated for in vitro cytotoxic activity by Sulforhodamine B (SRB) assay against a panel of four human cancer cell lines. Though the compounds showed varying degrees of cytotoxicity in the tested cell lines, most marked effect was observed in breast cancer cell line (MCF7), wherein nine of the ten synthesized chalcones showed good antiproliferative activity.