2-benzylsulfanyl-N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-chloro-5-methylbenzenesulfonamide | 1421610-88-9

• 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: 2-benzylsulfanyl-N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-chloro-5-methylbenzenesulfonamide
• CAS: 1421610-88-9
• 化学式: C₂₃H₂₀ClN₃O₂S₄
• 分子量: 534.148
• InChiKey: PLRLUSCCBVZMOI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.6
• 重原子数：
  33
• 可旋转键数：
  9
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  159
• 氢给体数：
  1
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  S-benzyldithiocarbazate 、 N-(2-benzylthio-4-chloro-5-methylbenzenesulfonyl)cyanamide potassium salt 以 溶剂黄146 为溶剂， 反应 8.0h， 以42%的产率得到2-benzylsulfanyl-N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-chloro-5-methylbenzenesulfonamide
  参考文献：
  名称：

  Synthesis and antibacterial activity of novel 4-chloro-2-mercaptobenzenesulfonamide derivatives

  摘要：

  Few series of novel 4-chloro-2-mercaptobenzenesulfonamides have been synthesized by the reactions of N-(benzenesulfonyl) cyanamide potassium salts 7-15 with corresponding hydrazinecarbodithioic acid esters, 1-substituted carbothioic acid hydrazides, methyl 3-aminothiophene-2-carboxylate, methyl 2-aminobenzoate, 2-aminophenol or 2-aminothiophenol. The synthesized compounds (16-49) were screened in vitro for their antibacterial activity. Some of the tested compounds 16, 17, 23, 24, 31, 32 and 48 showed the promising activity against many of anaerobic Gram-positive bacteria strains.

  DOI：

  10.3109/14756366.2011.625024

文献信息

• Synthesis and antibacterial activity of novel 4-chloro-2-mercaptobenzenesulfonamide derivatives
  作者：Jarosław Sławiński、Beata Żołnowska、Danuta Pirska、Anna Kędzia、Ewa Kwapisz

  DOI：10.3109/14756366.2011.625024

  日期：2013.2.1

  Few series of novel 4-chloro-2-mercaptobenzenesulfonamides have been synthesized by the reactions of N-(benzenesulfonyl) cyanamide potassium salts 7-15 with corresponding hydrazinecarbodithioic acid esters, 1-substituted carbothioic acid hydrazides, methyl 3-aminothiophene-2-carboxylate, methyl 2-aminobenzoate, 2-aminophenol or 2-aminothiophenol. The synthesized compounds (16-49) were screened in vitro for their antibacterial activity. Some of the tested compounds 16, 17, 23, 24, 31, 32 and 48 showed the promising activity against many of anaerobic Gram-positive bacteria strains.