N-benzyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide | 131236-85-6

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: N-benzyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide
• CAS: 131236-85-6
• 化学式: C₂₀H₁₈N₂O₃
• 分子量: 334.375
• InChiKey: OBSLWFYKNKDXGF-UHFFFAOYSA-N

物化性质

• 熔点：
  111-113 °C
• 沸点：
  544.5±50.0 °C(Predicted)
• 密度：
  1.201±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  25
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  60.4
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  2-氯烟酸 在 N-甲基吗啉 、 sodium hydride 、 氯甲酸异丁酯 作用下， 反应 19.83h， 生成 N-benzyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide
  参考文献：
  名称：

  Nicotinamide ethers: novel inhibitors of calcium-independent phosphodiesterase and [3H]rolipram binding

  摘要：

  The synthesis and biological properties of a series of nicotinamide ethers are described. These compounds, structurally novel calcium-independent phosphodiesterase inhibitors, also inhibit the binding of [H-3]rolipram to rat brain membranes and reverse reserpine-induced hypothermia in the mouse. Several compounds exhibited potent in vivo activity comparable to the standard agent, rolipram.

  DOI：

  10.1021/jm00105a015

文献信息

• ——
  作者：M. V. Pavlova、A. I. Mikhalev、M. E. Kon'shin、M. Yu. Vasil'eva、L. G. Mardanova、T. F. Odegova、M. I. Vakhrin

  DOI：10.1023/a:1015392529993

  日期：——
• VINICK, FREDRIC J.;SACCOMANO, NICHOLAS A.;KOE, B. KENNETH;NIELSEN, JANN A+, J. MED. CHEM., 34,(1991) N, C. 86-89
  作者：VINICK, FREDRIC J.、SACCOMANO, NICHOLAS A.、KOE, B. KENNETH、NIELSEN, JANN A+

  DOI：——

  日期：——
• Nicotinamide ethers: novel inhibitors of calcium-independent phosphodiesterase and [3H]rolipram binding
  作者：Fredric J. Vinick、Nicholas A. Saccomano、B. Kenneth Koe、Jann A. Nielsen、Ian H. Williams、Peter F. Thadeio、Stanley Jung、Morgan Meltz、Jonathan Johnson、Lorraine A. Lebel、Lorena L. Russo、David Helweg

  DOI：10.1021/jm00105a015

  日期：1991.1

  The synthesis and biological properties of a series of nicotinamide ethers are described. These compounds, structurally novel calcium-independent phosphodiesterase inhibitors, also inhibit the binding of [H-3]rolipram to rat brain membranes and reverse reserpine-induced hypothermia in the mouse. Several compounds exhibited potent in vivo activity comparable to the standard agent, rolipram.