3-(2,4-dichlorobenzyl)-6-(4-methoxyphenyl)-4H-[1,3]thiazolo[2,3-c][1,2,4]triazin-4-one | 1256383-02-4

• 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-(2,4-dichlorobenzyl)-6-(4-methoxyphenyl)-4H-[1,3]thiazolo[2,3-c][1,2,4]triazin-4-one
• 英文别名: 3-[(2,4-Dichlorophenyl)methyl]-6-(4-methoxyphenyl)-[1,3]thiazolo[2,3-c][1,2,4]triazin-4-one
• CAS: 1256383-02-4
• 化学式: C₁₉H₁₃Cl₂N₃O₂S
• 分子量: 418.303
• InChiKey: SKOJILJQRJLRKR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  27
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  79.6
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  6-(2,4-dichlorobenzyl)-3-((2-(4-methoxyphenyl)-2-oxoethyl)thio)-1,2,4-triazin-5(4H)-one 在 PPA 作用下， 反应 6.0h， 以65%的产率得到3-(2,4-dichlorobenzyl)-6-(4-methoxyphenyl)-4H-[1,3]thiazolo[2,3-c][1,2,4]triazin-4-one
  参考文献：
  名称：

  Synthesis and antimicrobial studies of thiazolotriazinones

  摘要：

  A series of 6-substitutedphenyl thiazolo-1,2,4-triazinones (8) were obtained by the initial reaction of 6-substituted arylmethyl-3-mercapto-1,2,4-triazin-5-ones (5) with substituted phenacyl bromides (6) and further followed by PPA cyclization. The structures of the newly synthesized compounds were confirmed by IR, H-1 NMR, Mass and analytical data. Compounds 8a, 8e, 8f and 8h exhibited good antimicrobial activity. (C) 2010 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2010.08.011

文献信息

• Synthesis and antimicrobial studies of thiazolotriazinones
  作者：Mari Sithambaram Karthikeyan

  DOI：10.1016/j.ejmech.2010.08.011

  日期：2010.11

  A series of 6-substitutedphenyl thiazolo-1,2,4-triazinones (8) were obtained by the initial reaction of 6-substituted arylmethyl-3-mercapto-1,2,4-triazin-5-ones (5) with substituted phenacyl bromides (6) and further followed by PPA cyclization. The structures of the newly synthesized compounds were confirmed by IR, H-1 NMR, Mass and analytical data. Compounds 8a, 8e, 8f and 8h exhibited good antimicrobial activity. (C) 2010 Elsevier Masson SAS. All rights reserved.