2-((2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy)ethyl ferulate | 1254065-23-0

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 肉桂酸及其衍生物
• 英文名称: 2-((2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy)ethyl ferulate
• 英文别名: acyclovir-2'-O-ferulate；2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]ethyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
• CAS: 1254065-23-0
• 化学式: C₁₈H₁₉N₅O₆
• 分子量: 401.379
• InChiKey: IECSHTCAEBOKPD-HWKANZROSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.4
• 重原子数：
  29
• 可旋转键数：
  9
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  150
• 氢给体数：
  3
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  阿昔洛韦 、 阿魏酸 在 N,N'-二环己基碳二亚胺 、 4-二甲氨基吡啶 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 26.0h， 以58%的产率得到2-((2-amino-1,6-dihydro-6-oxo-9H-purin-9-yl)methoxy)ethyl ferulate
  参考文献：
  名称：

  Cinnamic Esters of Acyclovir-Synthesis and Biological Activity

  摘要：

  In the present study we have synthesized esters of acyclovir (2-4) with cinnamic acids (p-coumaric, ferulic, and sinapic acids) and evaluated them for their antiviral and antioxidant potential. The antiviral activity of the newly synthesized compounds has been tested against human herpes virus 1 (HSV-1) in vitro. The results indicate that none of the synthesized compounds inhibits the tested virus strain. The antioxidant properties have been studied using 2,2-diphenyl-1-picrylhydrazyl (DPPH)* test.

  DOI：

  10.1080/15257770.2010.518185

文献信息

• Cinnamic Esters of Acyclovir-Synthesis and Biological Activity
  作者：Ivanka Stankova、Kiril Chuchkov、Peter Wutzler、Michaela Schmidtke

  DOI：10.1080/15257770.2010.518185

  日期：2010.10.6

  In the present study we have synthesized esters of acyclovir (2-4) with cinnamic acids (p-coumaric, ferulic, and sinapic acids) and evaluated them for their antiviral and antioxidant potential. The antiviral activity of the newly synthesized compounds has been tested against human herpes virus 1 (HSV-1) in vitro. The results indicate that none of the synthesized compounds inhibits the tested virus strain. The antioxidant properties have been studied using 2,2-diphenyl-1-picrylhydrazyl (DPPH)* test.