C-(5-Aminomethyl-biphenyl-3-yl)-methylamine | 221626-95-5

• 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: C-(5-Aminomethyl-biphenyl-3-yl)-methylamine
• CAS: 221626-95-5
• 化学式: C₁₄H₁₆N₂
• 分子量: 212.294
• InChiKey: CHAGTWBZJHOJJF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.27
• 重原子数：
  16.0
• 可旋转键数：
  3.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  52.04
• 氢给体数：
  2.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  C-(5-Aminomethyl-biphenyl-3-yl)-methylamine 在 盐酸 、 三乙胺 、 mercury dichloride 作用下， 以 乙酸乙酯 、 N,N-二甲基甲酰胺 为溶剂， 生成 N-(5-Guanidinomethyl-biphenyl-3-ylmethyl)-guanidine; compound with GENERIC INORGANIC NEUTRAL COMPONENT
  参考文献：
  名称：

  Aromatic analogs of arcaine inhibit MK-801 binding to the NMDA receptor

  摘要：

  Aromatic analogs of arcaine were shown to have inhibitory effects on the binding of the channel blocking drug [H-3]MK-801 to the NMDA receptor complex. The most potent compound of the series was an N,N'-bis(propyl)guanidinium which inhibited [H-3]MK-801 binding with an IC50 of 0.58 mu M and an IC50 of 12.17 mu M upon addition of 100 mu M spermidine. The increase in IC50 upon addition of spermidine suggests competitive antagonism between the inhibitor and spermidine at the arcaine-sensitive polyamine site of the NMDA receptor complex. (C) 1998 Published by Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(98)00631-3
• 作为产物：
  描述：

  3,5-二甲基溴苯 在 palladium on activated charcoal 吡啶 、 potassium permanganate 、 lithium aluminium tetrahydride 、 tetrakis-triphenylphosphine palladium(II) 、 硫酸 、 二苯基磷酸 、 氢气 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 四氢呋喃 、 甲醇 、 水 、 N,N-二甲基甲酰胺 为溶剂， 生成 C-(5-Aminomethyl-biphenyl-3-yl)-methylamine
  参考文献：
  名称：

  Aromatic analogs of arcaine inhibit MK-801 binding to the NMDA receptor

  摘要：

  Aromatic analogs of arcaine were shown to have inhibitory effects on the binding of the channel blocking drug [H-3]MK-801 to the NMDA receptor complex. The most potent compound of the series was an N,N'-bis(propyl)guanidinium which inhibited [H-3]MK-801 binding with an IC50 of 0.58 mu M and an IC50 of 12.17 mu M upon addition of 100 mu M spermidine. The increase in IC50 upon addition of spermidine suggests competitive antagonism between the inhibitor and spermidine at the arcaine-sensitive polyamine site of the NMDA receptor complex. (C) 1998 Published by Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(98)00631-3