1-(4-heptylphenyl)-4,5-diphenyl-1H-imidazol-2-amine | 1360998-13-5

• 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-heptylphenyl)-4,5-diphenyl-1H-imidazol-2-amine
• 英文别名: 1-(4-Heptylphenyl)-4,5-diphenylimidazol-2-amine；1-(4-heptylphenyl)-4,5-diphenylimidazol-2-amine
• CAS: 1360998-13-5
• 化学式: C₂₈H₃₁N₃
• 分子量: 409.574
• InChiKey: WEPOFHNTDUHCEI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.2
• 重原子数：
  31
• 可旋转键数：
  9
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  43.8
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1-(4-heptylphenyl)-4,5-diphenyl-1H-imidazol-2-amine 在 盐酸 作用下， 以 甲醇 、 水 为溶剂， 生成 1-(4-heptylphenyl)-4,5-diphenyl-1H-imidazol-2-amine hydrochloride
  参考文献：
  名称：

  A modular approach to the synthesis of 1,4,5-substituted-2-aminoimidazoles

  摘要：

  Diversified 1,4,5-substituted-2-aminoimidazoles were rapidly assembled via sequential N-H insertion and Grignard addition to alpha-diazoesters. Lead compounds were identified as antibiotics against Gram-positive bacteria with an MIC value as low as 2 mu g/mL. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2011.12.090
• 作为产物：
  描述：

  4-庚基苯胺 在 [ruthenium(II)(η⁶-1-methyl-4-isopropyl-benzene)(chloride)(μ-chloride)]₂ 、 异丙基氯化镁 、 sodium hydroxide 作用下， 以 四氢呋喃 、 乙醇 、 二氯甲烷 、 水 为溶剂， 反应 6.0h， 生成 1-(4-heptylphenyl)-4,5-diphenyl-1H-imidazol-2-amine
  参考文献：
  名称：

  A modular approach to the synthesis of 1,4,5-substituted-2-aminoimidazoles

  摘要：

  Diversified 1,4,5-substituted-2-aminoimidazoles were rapidly assembled via sequential N-H insertion and Grignard addition to alpha-diazoesters. Lead compounds were identified as antibiotics against Gram-positive bacteria with an MIC value as low as 2 mu g/mL. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2011.12.090

文献信息

• A modular approach to the synthesis of 1,4,5-substituted-2-aminoimidazoles
  作者：Zhaoming Su、Lingling Peng、Christian Melander

  DOI：10.1016/j.tetlet.2011.12.090

  日期：2012.3

  Diversified 1,4,5-substituted-2-aminoimidazoles were rapidly assembled via sequential N-H insertion and Grignard addition to alpha-diazoesters. Lead compounds were identified as antibiotics against Gram-positive bacteria with an MIC value as low as 2 mu g/mL. (C) 2011 Elsevier Ltd. All rights reserved.