N-benzyl-4-(3-(benzyloxy)-4-methoxyphenyl)pyridin-2-amine

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: N-benzyl-4-(3-(benzyloxy)-4-methoxyphenyl)pyridin-2-amine
• 英文别名: NEU-0000752；N-benzyl-4-(4-methoxy-3-phenylmethoxyphenyl)pyridin-2-amine
• 化学式: C₂₆H₂₄N₂O₂
• 分子量: 396.489
• InChiKey: AGGISMRIXJDMGS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.7
• 重原子数：
  30
• 可旋转键数：
  8
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  43.4
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2-(苄氧基)-4-溴苯甲醚 在 tris-(dibenzylideneacetone)dipalladium(0) 、 sodium carbonate 、 N,N-二异丙基乙胺 、 三苯基膦 作用下， 以 乙醇 、 水 、 甲苯 为溶剂， 反应 1.0h， 生成 N-benzyl-4-(3-(benzyloxy)-4-methoxyphenyl)pyridin-2-amine
  参考文献：
  名称：

  Synthesis and assessment of catechol diether compounds as inhibitors of trypanosomal phosphodiesterase B1 (TbrPDEB1)

  摘要：

  Human African trypanosomiasis (HAT) is a parasitic neglected tropical disease that affects 10,000 patients each year. Current treatments are sub-optimal, and the disease is fatal if not treated. Herein, we report our continuing efforts to repurpose the human phosphodiesterase 4 (hPDE4) inhibitor piclamilast to target trypanosomal phosphodiesterase TbrPDEB1. We prepared a range of substituted heterocyclic replacements for the 4-amino-3,5-dichloro-pyridine headgroup of piclamilast, and found that these compounds exhibited weak inhibitory activity of TbrPDEB1. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2013.08.057

文献信息

• Synthesis and assessment of catechol diether compounds as inhibitors of trypanosomal phosphodiesterase B1 (TbrPDEB1)
  作者：Jennifer L. Woodring、Nicholas D. Bland、Stefan O. Ochiana、Robert K. Campbell、Michael P. Pollastri

  DOI：10.1016/j.bmcl.2013.08.057

  日期：2013.11

  Human African trypanosomiasis (HAT) is a parasitic neglected tropical disease that affects 10,000 patients each year. Current treatments are sub-optimal, and the disease is fatal if not treated. Herein, we report our continuing efforts to repurpose the human phosphodiesterase 4 (hPDE4) inhibitor piclamilast to target trypanosomal phosphodiesterase TbrPDEB1. We prepared a range of substituted heterocyclic replacements for the 4-amino-3,5-dichloro-pyridine headgroup of piclamilast, and found that these compounds exhibited weak inhibitory activity of TbrPDEB1. (C) 2013 Elsevier Ltd. All rights reserved.