4-[5-((R)-5-Methanesulfonyloxymethyl-2-oxo-oxazolidin-3-yl)-pyridin-2-yl]-piperazine-1-carboxylic acid benzyl ester | 849145-82-0

• 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: 4-[5-((R)-5-Methanesulfonyloxymethyl-2-oxo-oxazolidin-3-yl)-pyridin-2-yl]-piperazine-1-carboxylic acid benzyl ester
• 英文别名: benzyl 4-[5-[(5R)-5-(methylsulfonyloxymethyl)-2-oxo-1,3-oxazolidin-3-yl]pyridin-2-yl]piperazine-1-carboxylate
• CAS: 849145-82-0
• 化学式: C₂₂H₂₆N₄O₇S
• 分子量: 490.537
• InChiKey: WZRIFJCZVCUTCT-LJQANCHMSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  34
• 可旋转键数：
  8
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  127
• 氢给体数：
  0
• 氢受体数：
  9

反应信息

• 作为反应物：
  描述：

  4-[5-((R)-5-Methanesulfonyloxymethyl-2-oxo-oxazolidin-3-yl)-pyridin-2-yl]-piperazine-1-carboxylic acid benzyl ester 在 palladium on activated charcoal sodium azide 、 氢气 、 三乙胺 作用下， 以 四氢呋喃 、 甲醇 、 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 41.0h， 生成 (S)-N-[3-[2-[4-(N-t-butoxycarbonyl)piperazin-1-yl]pyridin-5-yl]-2-oxooxazolidin-5-ylmethyl]acetamide
  参考文献：
  名称：

  Syntheses and antibacterial activity of a series of 3-(pyridine-3-yl)-2-oxazolidinone

  摘要：

  The syntheses of substituted piperazinyl pyridyl oxazolidinones 8-16 are described. Their in vitro activities against Gram-positive organisms such as Staphylococcus aureus, Staphylococcus epidermidis, Streptococcus and enterococcus were evaluated by minimum inhibitory concentration (MIC) determination. Compound 8 and 10 were found to be superior to linezolid. (C) 2005 Elsevier SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2004.10.012
• 作为产物：
  描述：

  6-(1-哌嗪基)-3-吡啶胺 在 正丁基锂 、 sodium carbonate 、 三乙胺 作用下， 以 四氢呋喃 、 正己烷 、 二氯甲烷 、 水 、 丙酮 为溶剂， 反应 5.5h， 生成 4-[5-((R)-5-Methanesulfonyloxymethyl-2-oxo-oxazolidin-3-yl)-pyridin-2-yl]-piperazine-1-carboxylic acid benzyl ester
  参考文献：
  名称：

  Syntheses and antibacterial activity of a series of 3-(pyridine-3-yl)-2-oxazolidinone

  摘要：

  The syntheses of substituted piperazinyl pyridyl oxazolidinones 8-16 are described. Their in vitro activities against Gram-positive organisms such as Staphylococcus aureus, Staphylococcus epidermidis, Streptococcus and enterococcus were evaluated by minimum inhibitory concentration (MIC) determination. Compound 8 and 10 were found to be superior to linezolid. (C) 2005 Elsevier SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2004.10.012

文献信息

• Syntheses and antibacterial activity of a series of 3-(pyridine-3-yl)-2-oxazolidinone
  作者：Yingjie Cui、Yaxian Dang、Yushe Yang、Shuhua Zhang、Ruyun Ji

  DOI：10.1016/j.ejmech.2004.10.012

  日期：2005.2

  The syntheses of substituted piperazinyl pyridyl oxazolidinones 8-16 are described. Their in vitro activities against Gram-positive organisms such as Staphylococcus aureus, Staphylococcus epidermidis, Streptococcus and enterococcus were evaluated by minimum inhibitory concentration (MIC) determination. Compound 8 and 10 were found to be superior to linezolid. (C) 2005 Elsevier SAS. All rights reserved.