3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propyl hydrogen sulfate | 1276028-80-8

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 2-芳基苯并呋喃类黄酮
• 英文名称: 3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propyl hydrogen sulfate
• 英文别名: 3-[2-(1,3-Benzodioxol-5-yl)-7-methoxy-benzofuran-5-yl]propyl hydrogen sulfate
• CAS: 1276028-80-8
• 化学式: C₁₉H₁₈O₈S
• 分子量: 406.413
• InChiKey: XESUNYHJOXXRLN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  28
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  113
• 氢给体数：
  1
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  5-(3-羟基丙基)-7-甲氧基-2-(3,4-亚甲二氧基苯基)苯并呋喃 在 硫酸 作用下， 以 二氯甲烷 、 乙腈 为溶剂， 反应 18.0h， 以40.5%的产率得到3-[2-(1,3-benzodioxol-5-yl)-7-methoxy-1-benzofuran-5-yl]propyl hydrogen sulfate
  参考文献：
  名称：

  Synthesis of egonol derivatives and their antimicrobial activities

  摘要：

  Eighteen derivatives of egonol (A-R) were synthesized and evaluated for their antimicrobial activities against Staphylococcus aureus ATCC 29213, Bacillus subtilis ATCC 6633, Candida albicans ATCC 10231 and Escherichia coli ATCC 8739 microorganisms comparing with egonol. The obtained data reported that compound B exhibited improved activities against all tested bacteria than egonol, others have shown different range of activities. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2010.12.044

文献信息

• Synthesis of egonol derivatives and their antimicrobial activities
  作者：Safiye Emirdağ-Öztürk、Tamer Karayildirim、Hüseyin Anil

  DOI：10.1016/j.bmc.2010.12.044

  日期：2011.2

  Eighteen derivatives of egonol (A-R) were synthesized and evaluated for their antimicrobial activities against Staphylococcus aureus ATCC 29213, Bacillus subtilis ATCC 6633, Candida albicans ATCC 10231 and Escherichia coli ATCC 8739 microorganisms comparing with egonol. The obtained data reported that compound B exhibited improved activities against all tested bacteria than egonol, others have shown different range of activities. (C) 2010 Elsevier Ltd. All rights reserved.