O-<4-Butyloxy-benzyl>-hydroxylamin | 21038-25-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: O-<4-Butyloxy-benzyl>-hydroxylamin
• 英文别名: O-(p-Butoxybenzyl)hydroxylamine；O-[(4-butoxyphenyl)methyl]hydroxylamine
• CAS: 21038-25-5
• 化学式: C₁₁H₁₇NO₂
• 分子量: 195.261
• InChiKey: BEONHAAXJCLBRC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2
• 重原子数：
  14
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  44.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  O-<4-Butyloxy-benzyl>-hydroxylamin 在 三氟乙酸 作用下， 以 甲醇 、 水 为溶剂， 生成 ethyl 4-[5-[[(1E)-1-[(4-butoxyphenyl)methoxyimino]-3-hydroxypropan-2-yl]carbamoyl]-7-methoxy-1,3-benzodioxol-4-yl]-7-methoxy-1,3-benzodioxole-5-carboxylate
  参考文献：
  名称：

  A solid-phase approach to DDB derivatives

  摘要：

  Since the discovery of 2,2'-dimethoxycarbonyl-4,4-dimethoxy-5,6,5',6'-biomethylenedioxy-biphenyl (DDB) as a potent anti-HBV agent, we have studied the structure-activity relationships of 4,4'-dimethoxy -5,6,5',6'-dimethenedioxy-2-alkyloxycarbonyl-2'-(4- substituted benzyl piperazin-1-yl)carbonyl-biphenyl as anti-HBV agents. Therefore, it is rational to extend this study to the 3,3'-disustituted-4,4'-dimethoxy5,6,5',6'-dimethenedioxy-2-alkyloxycarbonyl-2'-Serine derivatives. Thus, in an attempt to develop an efficient method for the preparation of a large number of DDB derivatives, the reaction between a DDB acid chloride and serine derivatives on solid support was studied. The structure of resulted compounds was confirmed by LC-MS and H-1 NMR analysis. Compounds 2a, 2d, 2f, 2j showed in vitro anti-HBV activity without significant toxicity up to 100 mu M. (c) 2005 Elsevier SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2005.03.024
• 作为产物：
  描述：

  4-丁氧基苯甲醇 在 偶氮二甲酸二异丙酯 、 三苯基膦 、 肼 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 生成 O-<4-Butyloxy-benzyl>-hydroxylamin
  参考文献：
  名称：

  A solid-phase approach to DDB derivatives

  摘要：

  Since the discovery of 2,2'-dimethoxycarbonyl-4,4-dimethoxy-5,6,5',6'-biomethylenedioxy-biphenyl (DDB) as a potent anti-HBV agent, we have studied the structure-activity relationships of 4,4'-dimethoxy -5,6,5',6'-dimethenedioxy-2-alkyloxycarbonyl-2'-(4- substituted benzyl piperazin-1-yl)carbonyl-biphenyl as anti-HBV agents. Therefore, it is rational to extend this study to the 3,3'-disustituted-4,4'-dimethoxy5,6,5',6'-dimethenedioxy-2-alkyloxycarbonyl-2'-Serine derivatives. Thus, in an attempt to develop an efficient method for the preparation of a large number of DDB derivatives, the reaction between a DDB acid chloride and serine derivatives on solid support was studied. The structure of resulted compounds was confirmed by LC-MS and H-1 NMR analysis. Compounds 2a, 2d, 2f, 2j showed in vitro anti-HBV activity without significant toxicity up to 100 mu M. (c) 2005 Elsevier SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2005.03.024

文献信息

• Markova,Yu.V. et al., Journal of Organic Chemistry USSR (English Translation), 1967, vol. 3, p. 1170 - 1174
  作者：Markova,Yu.V. et al.

  DOI：——

  日期：——
• A solid-phase approach to DDB derivatives
  作者：Xiuxiang Qi、Xiaolai Wang、Limin Wang、Qiang Wang、Senxiang Cheng、Jishuan Suo、Junbiao Chang

  DOI：10.1016/j.ejmech.2005.03.024

  日期：2005.8

  Since the discovery of 2,2'-dimethoxycarbonyl-4,4-dimethoxy-5,6,5',6'-biomethylenedioxy-biphenyl (DDB) as a potent anti-HBV agent, we have studied the structure-activity relationships of 4,4'-dimethoxy -5,6,5',6'-dimethenedioxy-2-alkyloxycarbonyl-2'-(4- substituted benzyl piperazin-1-yl)carbonyl-biphenyl as anti-HBV agents. Therefore, it is rational to extend this study to the 3,3'-disustituted-4,4'-dimethoxy5,6,5',6'-dimethenedioxy-2-alkyloxycarbonyl-2'-Serine derivatives. Thus, in an attempt to develop an efficient method for the preparation of a large number of DDB derivatives, the reaction between a DDB acid chloride and serine derivatives on solid support was studied. The structure of resulted compounds was confirmed by LC-MS and H-1 NMR analysis. Compounds 2a, 2d, 2f, 2j showed in vitro anti-HBV activity without significant toxicity up to 100 mu M. (c) 2005 Elsevier SAS. All rights reserved.