1-(4-Azido-2-methoxyphenyl)-4-methylimidazole | 1315141-29-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 1-(4-Azido-2-methoxyphenyl)-4-methylimidazole
• 英文别名: 1-(4-azido-2-methoxyphenyl)-4-methylimidazole
• CAS: 1315141-29-7
• 化学式: C₁₁H₁₁N₅O
• 分子量: 229.241
• InChiKey: REWBVTMXLZQVAA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.13
• 重原子数：
  17.0
• 可旋转键数：
  3.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  75.81
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  炔丙基三甲基硅烷 、 1-(4-Azido-2-methoxyphenyl)-4-methylimidazole 在 copper(II) sulfate 、 sodium ascorbate 作用下， 以 乙醇 、 水 为溶剂， 生成 [1-[3-Methoxy-4-(4-methylimidazol-1-yl)phenyl]triazol-4-yl]methyl-trimethylsilane
  参考文献：
  名称：

  Triazoles as γ-secretase modulators

  摘要：

  Synthesis, SAR, and evaluation of aryl triazoles as novel gamma secretase modulators (GSMs) are presented in this communication. Starting from the literature and in-house leads, we evaluated a range of five-membered heterocycles as replacements for olefins commonly found in non-acid GSMs. 1,2,3-C-aryl-triazoles were identified as suitable replacements which exhibited good modulation of gamma-secretase activity, excellent pharmacokinetics and good central lowering of A beta 42 in Sprague-Dawley rats. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.04.089
• 作为产物：
  描述：

  2-溴-5-硝基苯甲醚 在 sodium azide 、 10% palladium on activated charcoal 、 氢气 、 potassium carbonate 、 sodium nitrite 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 1-(4-Azido-2-methoxyphenyl)-4-methylimidazole
  参考文献：
  名称：

  Triazoles as γ-secretase modulators

  摘要：

  Synthesis, SAR, and evaluation of aryl triazoles as novel gamma secretase modulators (GSMs) are presented in this communication. Starting from the literature and in-house leads, we evaluated a range of five-membered heterocycles as replacements for olefins commonly found in non-acid GSMs. 1,2,3-C-aryl-triazoles were identified as suitable replacements which exhibited good modulation of gamma-secretase activity, excellent pharmacokinetics and good central lowering of A beta 42 in Sprague-Dawley rats. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.04.089