[3-((2R,4S)-3-Benzoyl-4-methyl-5-oxo-2-phenyl-oxazolidin-4-ylmethyl)-phenyl]-phosphonic acid diethyl ester | 216491-39-3

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: [3-((2R,4S)-3-Benzoyl-4-methyl-5-oxo-2-phenyl-oxazolidin-4-ylmethyl)-phenyl]-phosphonic acid diethyl ester
• CAS: 216491-39-3
• 化学式: C₂₈H₃₀NO₆P
• 分子量: 507.523
• InChiKey: IHUWDHPQEGREJC-IAPPQJPRSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.28
• 重原子数：
  36.0
• 可旋转键数：
  9.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  82.14
• 氢给体数：
  0.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  [3-((2R,4S)-3-Benzoyl-4-methyl-5-oxo-2-phenyl-oxazolidin-4-ylmethyl)-phenyl]-phosphonic acid diethyl ester 在 sodium hydroxide 作用下， 以 甲醇 为溶剂， 反应 0.5h， 以93%的产率得到
  参考文献：
  名称：

  Synthesis and biological evaluation of two analogues of (S)-α-methyl-3-carboxyphenylalanine

  摘要：

  Two analogues 2, 3 of (S)-alpha-methyl-3-carboxylphenylalanine 1 were synthesized to test their activity for metabotropic glutamate receptors (mGluRs). Both compounds 2 and 3 were inactive as antagonist for mGluRs, but 2 showed weak agonistic activity for GluR6 in contrast to that reported by Kemp and co-workers.

  DOI：

  10.1016/s0960-894x(98)00409-0
• 作为产物：
  描述：

  (2R,4S)-3-Benzoyl-4-(3-benzyloxy-benzyl)-4-methyl-2-phenyl-oxazolidin-5-one 在 palladium on activated charcoal 4-二甲氨基吡啶 、 四(三苯基膦)钯 、 氢气 、 三乙胺 作用下， 以 乙醇 、 二氯甲烷 为溶剂， 反应 4.0h， 生成 [3-((2R,4S)-3-Benzoyl-4-methyl-5-oxo-2-phenyl-oxazolidin-4-ylmethyl)-phenyl]-phosphonic acid diethyl ester
  参考文献：
  名称：

  Synthesis and biological evaluation of two analogues of (S)-α-methyl-3-carboxyphenylalanine

  摘要：

  Two analogues 2, 3 of (S)-alpha-methyl-3-carboxylphenylalanine 1 were synthesized to test their activity for metabotropic glutamate receptors (mGluRs). Both compounds 2 and 3 were inactive as antagonist for mGluRs, but 2 showed weak agonistic activity for GluR6 in contrast to that reported by Kemp and co-workers.

  DOI：

  10.1016/s0960-894x(98)00409-0