N'-amino-1-methylindole-3-carboximidamide | 850450-06-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: N'-amino-1-methylindole-3-carboximidamide
• CAS: 850450-06-5
• 化学式: C₁₀H₁₂N₄
• 分子量: 188.232
• InChiKey: JHPFGLUFDYUPRN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  69.3
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  N'-amino-1-methylindole-3-carboximidamide 在 氢氧化钾 、 四丁基溴化铵 、 magnesium sulfate 作用下， 以 四氢呋喃 、 甲醇 、 水 为溶剂， 反应 72.0h， 生成 3,6-Bis(1-methylindol-3-yl)-2-prop-2-enyl-1,2,4-triazin-5-one
  参考文献：
  名称：

  Synthesis of bis(indole)-1,2,4-triazinones

  摘要：

  A facile method for the synthesis of para- and meta-substituted bis(indole)- 1,2,4-triazinones is presented. Our approach to access these triazinones involves a cyclocondensation reaction between amidrazone and ketoester functionalities. The structures of these interesting compounds were established unambiguously by X-ray crystallography. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2005.01.162
• 作为产物：
  描述：

  3-氰基-1-甲基吲哚 在 sodium hydride 、 肼 作用下， 以 四氢呋喃 、 乙醚 为溶剂， 反应 6.0h， 以79%的产率得到N'-amino-1-methylindole-3-carboximidamide
  参考文献：
  名称：

  Synthesis of bis(indole)-1,2,4-triazinones

  摘要：

  A facile method for the synthesis of para- and meta-substituted bis(indole)- 1,2,4-triazinones is presented. Our approach to access these triazinones involves a cyclocondensation reaction between amidrazone and ketoester functionalities. The structures of these interesting compounds were established unambiguously by X-ray crystallography. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2005.01.162

文献信息

• Synthesis of bis(indole)-1,2,4-triazinones
  作者：Neil K. Garg、Brian M. Stoltz

  DOI：10.1016/j.tetlet.2005.01.162

  日期：2005.3

  A facile method for the synthesis of para- and meta-substituted bis(indole)- 1,2,4-triazinones is presented. Our approach to access these triazinones involves a cyclocondensation reaction between amidrazone and ketoester functionalities. The structures of these interesting compounds were established unambiguously by X-ray crystallography. (C) 2005 Elsevier Ltd. All rights reserved.