3-chloro-N'-[(4-methylphenyl)sulfonyl]propanoylhydrazide | 895821-74-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 3-chloro-N'-[(4-methylphenyl)sulfonyl]propanoylhydrazide
• 英文别名: 3-chloro-N'-(4-methylphenyl)sulfonylpropanehydrazide
• CAS: 895821-74-6
• 化学式: C₁₀H₁₃ClN₂O₃S
• 分子量: 276.744
• InChiKey: WHXLRROLSWJGRV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.3
• 重原子数：
  17
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  83.6
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  3-chloro-N'-[(4-methylphenyl)sulfonyl]propanoylhydrazide 、 1,3-diazaspiro[4,5]decane-2,4-dithione potassium salt 在 potassium iodide 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 12.0h， 以55%的产率得到2,4-bis{3-[2-(4-methylphenyl)sulfonyl]hydrazino-3-oxopropylthio}-1,3-diazaspiro[4.5]deca-1,3-diene
  参考文献：
  名称：

  Synthesis of 5-spirocyclohexyl-2,4-dithiohydantoin derivatives: a potential anti-leishmaniasis agent

  摘要：

  A series of spiro-dithiohydantoins were synthesized by heating a mixture of 5-spirocyclohexyl-2,4dithiohydantoin potassium salt and 3-chloropropanoyl chloride. These compounds were synthesized and evaluated for their activity against five Leishmanial strains in the promastigote stage in vitro. Seventy-two hours inoculation of a variety of products gave an IC100 and average IC50 values of 1.25 and 0.376 mg/cm(3) against all Leishmanial strains tested.

  DOI：

  10.1007/s00706-008-0063-9
• 作为产物：
  描述：

  对甲苯磺酰肼 、 3-氯丙酰氯 以 苯 为溶剂， 反应 1.0h， 以93%的产率得到3-chloro-N'-[(4-methylphenyl)sulfonyl]propanoylhydrazide
  参考文献：
  名称：

  Synthesis of 5-spirocyclohexyl-2,4-dithiohydantoin derivatives: a potential anti-leishmaniasis agent

  摘要：

  A series of spiro-dithiohydantoins were synthesized by heating a mixture of 5-spirocyclohexyl-2,4dithiohydantoin potassium salt and 3-chloropropanoyl chloride. These compounds were synthesized and evaluated for their activity against five Leishmanial strains in the promastigote stage in vitro. Seventy-two hours inoculation of a variety of products gave an IC100 and average IC50 values of 1.25 and 0.376 mg/cm(3) against all Leishmanial strains tested.

  DOI：

  10.1007/s00706-008-0063-9