2-(methylamino)-2-<3-(bicyclo<2.2.2>oct-2-yloxy)-4-methoxyphenyl>ethylamine | 115897-79-5

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 异戊烯醇脂质
• 英文名称: 2-(methylamino)-2-<3-(bicyclo<2.2.2>oct-2-yloxy)-4-methoxyphenyl>ethylamine
• 英文别名: 2-(methylamino)-2-[3-(bicyclo[2.2.2]oct-2-yloxy)-4-methoxyphenyl]ethylamine；1-[3-(2-bicyclo[2.2.2]octanyloxy)-4-methoxyphenyl]-N-methylethane-1,2-diamine
• CAS: 115897-79-5；131408-16-7；131408-65-6
• 化学式: C₁₈H₂₈N₂O₂
• 分子量: 304.433
• InChiKey: ANGZPQLAWYRVJZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  22
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  56.5
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2-(methylamino)-2-<3-(bicyclo<2.2.2>oct-2-yloxy)-4-methoxyphenyl>ethylamine 、 N,N'-羰基二咪唑 以 四氢呋喃 为溶剂， 反应 40.0h， 以32%的产率得到1-methyl-5-[3-(bicyclo[2.2.2]oct-2-yloxy)-4-methoxyphenyl]-2-imidazolidinone
  参考文献：
  名称：

  Calcium-independent phosphodiesterase inhibitors as putative antidepressants: [3-(bicycloalkyloxy)-4-methoxyphenyl-2-imidazolidinones

  摘要：

  The synthesis and biological properties of a novel series of selective calcium-independent phosphodiesterase inhibitors are described. These compounds also inhibit the specific binding of [H-3]rolipram to rat brain membranes and exhibit efficacy in preclinical models of antidepressant activity in mice, such as reducing immobility in the forced-swim test and reversing reserpine-induced hypothermia. Imidazolidinones 4 and 16 were found to be the most potent compounds studied.

  DOI：

  10.1021/jm00105a045
• 作为产物：
  描述：

  异香兰素 在 二异丁基氢化铝 、 三苯基膦 、 偶氮二甲酸二乙酯 作用下， 以 四氢呋喃 、 乙醇 、 水 、 甲苯 为溶剂， 反应 124.0h， 生成 2-(methylamino)-2-<3-(bicyclo<2.2.2>oct-2-yloxy)-4-methoxyphenyl>ethylamine
  参考文献：
  名称：

  Calcium-independent phosphodiesterase inhibitors as putative antidepressants: [3-(bicycloalkyloxy)-4-methoxyphenyl-2-imidazolidinones

  摘要：

  The synthesis and biological properties of a novel series of selective calcium-independent phosphodiesterase inhibitors are described. These compounds also inhibit the specific binding of [H-3]rolipram to rat brain membranes and exhibit efficacy in preclinical models of antidepressant activity in mice, such as reducing immobility in the forced-swim test and reversing reserpine-induced hypothermia. Imidazolidinones 4 and 16 were found to be the most potent compounds studied.

  DOI：

  10.1021/jm00105a045

文献信息

• SACCOMANO, NICHOLAS A.;VINICK, FREDERIC J.;KOE, KENNETH B.;NIELSEN, JANN +, J. MED. CHEM., 34,(1991) N, C. 291-298
  作者：SACCOMANO, NICHOLAS A.、VINICK, FREDERIC J.、KOE, KENNETH B.、NIELSEN, JANN +

  DOI：——

  日期：——