(4-Benzyloxy-3,5-dimethoxy-phenyl)-[2-(diphenyl-phosphinoyl)-pyrrolidin-1-yl]-methanone | 302968-98-5

• 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: (4-Benzyloxy-3,5-dimethoxy-phenyl)-[2-(diphenyl-phosphinoyl)-pyrrolidin-1-yl]-methanone
• CAS: 302968-98-5
• 化学式: C₃₂H₃₂NO₅P
• 分子量: 541.584
• InChiKey: FCTINHMMHWKPPT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.86
• 重原子数：
  39.0
• 可旋转键数：
  9.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  65.07
• 氢给体数：
  0.0
• 氢受体数：
  5.0

反应信息

• 作为反应物：
  描述：

  benzyloxy-2 piperonal 、 (4-Benzyloxy-3,5-dimethoxy-phenyl)-[2-(diphenyl-phosphinoyl)-pyrrolidin-1-yl]-methanone 在 正丁基锂 作用下， 以 四氢呋喃 、 正己烷 为溶剂， 生成 {2-[1-(4-Benzyloxy-benzo[1,3]dioxol-5-yl)-meth-(Z)-ylidene]-pyrrolidin-1-yl}-(4-benzyloxy-3,5-dimethoxy-phenyl)-methanone 、 {2-[1-(4-Benzyloxy-benzo[1,3]dioxol-5-yl)-meth-(E)-ylidene]-pyrrolidin-1-yl}-(4-benzyloxy-3,5-dimethoxy-phenyl)-methanone
  参考文献：
  名称：

  First synthesis and pharmacological evaluation of benzoindolizidine and benzoquinolizidine analogues of α- and β-peltatin

  摘要：

  The benzoindolizidine and-quinolizidine analogues of alpha- and beta-peltatin were designed and synthesized by two different synthetic routes involving as the key step the Bischler-Napieralski cyclization of suitably substituted N-acyl-2-arylmethylpyrrolidine and -piperidine derivatives. The in vitro biological activity of these analogues as well as some of their derivatives was subsequently evaluated. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0968-0896(00)00130-9
• 作为产物：
  描述：

  Diphenylphosphine oxide 在 4-二甲氨基吡啶 、 三乙胺 、 N,N'-二环己基碳二亚胺 作用下， 以 二氯甲烷 、 甲苯 为溶剂， 生成 (4-Benzyloxy-3,5-dimethoxy-phenyl)-[2-(diphenyl-phosphinoyl)-pyrrolidin-1-yl]-methanone
  参考文献：
  名称：

  First synthesis and pharmacological evaluation of benzoindolizidine and benzoquinolizidine analogues of α- and β-peltatin

  摘要：

  The benzoindolizidine and-quinolizidine analogues of alpha- and beta-peltatin were designed and synthesized by two different synthetic routes involving as the key step the Bischler-Napieralski cyclization of suitably substituted N-acyl-2-arylmethylpyrrolidine and -piperidine derivatives. The in vitro biological activity of these analogues as well as some of their derivatives was subsequently evaluated. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0968-0896(00)00130-9