threo-(+/-)-N-(3,4-Diphenyl-2-methyl-3-butanol)propionsaeureamid

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二苯乙烯类
• 英文名称: threo-(+/-)-N-(3,4-Diphenyl-2-methyl-3-butanol)propionsaeureamid
• 英文别名: (2RS,3SR)-3-methyl-1,2-diphenyl-4-propionylamino-butan-2-ol；N-[(2R,3S)-3-hydroxy-2-methyl-3,4-diphenylbutyl]propanamide
• 化学式: C₂₀H₂₅NO₂
• 分子量: 311.424
• InChiKey: SWFORRZGJNFIIU-UZLBHIALSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  23
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  49.3
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  threo-(+/-)-N-(3,4-Diphenyl-2-methyl-3-butanol)propionsaeureamid 在 palladium on activated charcoal 五氯化磷 、 氢气 、 三乙胺 作用下， 以 乙醇 、 氯仿 、 正戊烷 、 苯 为溶剂， 生成 threo-(+/-)-4-Amino-1,2-diphenyl-3-methyl-3-butanolpropionat
  参考文献：
  名称：

  Synthesis of two metabolites of (+)-propoxyphene

  摘要：

  Two minor metabolites of (+)-propoxyphene were prepared in both the (+/-) and (+) forms. The optically pure forms were synthesized by a degradative route from (+)-propoxyphene. The di-N-demethylated metabolite 10a,b had weak analgesic activity while the cyclized oxazine metabolite 7a was inactive.

  DOI：

  10.1021/jm00218a015
• 作为产物：
  描述：

  [(2R,3S)-3-hydroxy-2-methyl-3,4-diphenylbutyl] 4-methylbenzenesulfonate 在 氨 、 三乙胺 作用下， 以 苯 为溶剂， 生成 threo-(+/-)-N-(3,4-Diphenyl-2-methyl-3-butanol)propionsaeureamid
  参考文献：
  名称：

  Synthesis of two metabolites of (+)-propoxyphene

  摘要：

  Two minor metabolites of (+)-propoxyphene were prepared in both the (+/-) and (+) forms. The optically pure forms were synthesized by a degradative route from (+)-propoxyphene. The di-N-demethylated metabolite 10a,b had weak analgesic activity while the cyclized oxazine metabolite 7a was inactive.

  DOI：

  10.1021/jm00218a015

文献信息

• Synthesis of two metabolites of (+)-propoxyphene
  作者：William W. Turner、Richard N. Booher、Stephen E. Smits、Albert Pohland

  DOI：10.1021/jm00218a015

  日期：1977.8

  Two minor metabolites of (+)-propoxyphene were prepared in both the (+/-) and (+) forms. The optically pure forms were synthesized by a degradative route from (+)-propoxyphene. The di-N-demethylated metabolite 10a,b had weak analgesic activity while the cyclized oxazine metabolite 7a was inactive.