2-[3-[[4-(1,2-Dimethylimidazol-4-yl)sulfonylpiperazin-1-yl]methyl]phenoxy]ethanol | 1136778-82-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-[3-[[4-(1,2-Dimethylimidazol-4-yl)sulfonylpiperazin-1-yl]methyl]phenoxy]ethanol
• CAS: 1136778-82-9
• 化学式: C₁₈H₂₆N₄O₄S
• 分子量: 394.495
• InChiKey: QZFGPCRIXOQUCN-UHFFFAOYSA-N

物化性质

• 沸点：
  616.3±65.0 °C(predicted)
• 密度：
  1.33±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  27
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  96.3
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  1,2-二甲基-1H-咪唑-4-磺酰氯 、 1-[(2-硝基苯基)磺酰基]哌嗪 、 alkaline earth salt of/the/ methylsulfuric acid 生成 2-[3-[[4-(1,2-Dimethylimidazol-4-yl)sulfonylpiperazin-1-yl]methyl]phenoxy]ethanol
  参考文献：
  名称：

  N-Benzyl-3-sulfonamidopyrrolidines as novel inhibitors of cell division in E. coli

  摘要：

  A new small molecule inhibitor of bacterial cell division has been discovered using a high-throughput screen in Escherichia coli. Although the lead screening hit (534F6) exhibited modest inhibition of the GTPase activity of FtsZ (20 +/- 5% at 100 mu M of compound), a primary target for bacterial cell division inhibitors, several analogs caused potent bacterial growth inhibition with negligible antagonism of FtsZ GTPase activity. A library of analogs has been prepared and several alkyne-tagged photo-affinity probes have been synthesized for use in experiments to elucidate the primary target of this compound. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2007.09.010