5-[(N-methylpiperazino)methyl]-5-oxo-1,3,2λ4,5λ5-dioxaselenaphosphinan-2-one | 1233542-14-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: 5-[(N-methylpiperazino)methyl]-5-oxo-1,3,2λ4,5λ5-dioxaselenaphosphinan-2-one
• 英文别名: 5-[(4-Methylpiperazin-1-yl)methyl]-1,3,2lambda4,5lambda5-dioxaselenaphosphinane 2,5-dioxide；5-[(4-methylpiperazin-1-yl)methyl]-1,3,2λ4,5λ5-dioxaselenaphosphinane 2,5-dioxide
• CAS: 1233542-14-7
• 化学式: C₈H₁₇N₂O₄PSe
• 分子量: 315.168
• InChiKey: HIPBNGNQEQEHNL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.07
• 重原子数：
  16
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  59.1
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  N-甲基哌嗪 、 5-(bromomethyl)-5-oxo-1,3,2λ4, 5λ5-dioxaselenaphosphinan-2-one 在 三乙胺 作用下， 以 四氢呋喃 为溶剂， 以71%的产率得到5-[(N-methylpiperazino)methyl]-5-oxo-1,3,2λ4,5λ5-dioxaselenaphosphinan-2-one
  参考文献：
  名称：

  Synthesis, Spectral Characterization and Antimicrobial Activity of Novel 5-[(Substituted Methyl]-5-oxo-1,3,2λ4,5λ5-dioxaselena Phosphinan-2-ones

  摘要：

  A series of novel 5-[(substituted) methyl]-5-oxo-1,3,2 lambda(4),5 lambda(5)-dioxa selenaphosphinan-2-ones (4-17) were successfully synthesized from tris(bromomethyl)phosphine oxide (I) and sodium selenite (2) to form the intermediate(3) which on further treatment with various alcohols/ thiols/ phenols/ aminoacid esters afforded the title compounds (4-17) and their structures were established by multinuclear NMR (H-1-, C-13- and P-31-) and mass spectral data. Their antimicrobial activity was evaluated and they exhibited promising antibacterial activity.

  DOI：

  10.3987/com-10-11910