(2-Benzo[1,3]dioxol-5-yl-ethyl)-(4-benzyloxy-benzyl)-amine | 880344-85-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并间二氧杂环戊烯类
• 英文名称: (2-Benzo[1,3]dioxol-5-yl-ethyl)-(4-benzyloxy-benzyl)-amine
• 英文别名: 2-(1,3-benzodioxol-5-yl)-N-[(4-phenylmethoxyphenyl)methyl]ethanamine
• CAS: 880344-85-4
• 化学式: C₂₃H₂₃NO₃
• 分子量: 361.441
• InChiKey: DHNQWDRPMNDPHA-UHFFFAOYSA-N

物化性质

• 沸点：
  520.4±45.0 °C(Predicted)
• 密度：
  1.188±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.33
• 重原子数：
  27.0
• 可旋转键数：
  8.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  39.72
• 氢给体数：
  1.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  (2-Benzo[1,3]dioxol-5-yl-ethyl)-(4-benzyloxy-benzyl)-amine 、 草酸醛 在 copper(II) sulfate 、 溶剂黄146 、 sodium chloride 作用下， 反应 6.5h， 以60%的产率得到18-Phenylmethoxy-5,7-dioxa-13-azoniapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-1(13),2,4(8),9,14,16,18,20-octaene
  参考文献：
  名称：

  Synthesis and antihyperglycemic evaluation of various protoberberine derivatives

  摘要：

  Various berberine derivatives (2-17) were synthesized and their antihyperglycemic activities were evaluated in a model of beta-cell-membrane chromatography and a model of alloxan-induced diabetes mice. The results indicated that compounds 5 and 14 exhibited antihyperglycemic activity. Their structure-activity relationships were discussed. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.11.045
• 作为产物：
  描述：

  4-苄氧基苯甲醛 在 sodium tetrahydroborate 作用下， 以 甲醇 为溶剂， 反应 3.0h， 生成 (2-Benzo[1,3]dioxol-5-yl-ethyl)-(4-benzyloxy-benzyl)-amine
  参考文献：
  名称：

  Synthesis and antihyperglycemic evaluation of various protoberberine derivatives

  摘要：

  Various berberine derivatives (2-17) were synthesized and their antihyperglycemic activities were evaluated in a model of beta-cell-membrane chromatography and a model of alloxan-induced diabetes mice. The results indicated that compounds 5 and 14 exhibited antihyperglycemic activity. Their structure-activity relationships were discussed. (C) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.11.045