6-Ethylsulfanyl-1-methyl-3,1-benzoxazine-2,4-dione | 147079-49-0

• 分子结构分类: 有机化合物 - 有机杂环化合物
• 英文名称: 6-Ethylsulfanyl-1-methyl-3,1-benzoxazine-2,4-dione
• CAS: 147079-49-0
• 化学式: C₁₁H₁₁NO₃S
• 分子量: 237.279
• InChiKey: PGBQSWIJTSSDBL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  16
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  71.9
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  ethyl 3-(methyl(phenyl)amino)-3-oxopropanoate 、 6-Ethylsulfanyl-1-methyl-3,1-benzoxazine-2,4-dione 在 2,4-滴二甲胺盐 、 sodium hydride 作用下， 生成 6-ethylsulfanyl-4-hydroxy-N,1-dimethyl-2-oxo-N-phenylquinoline-3-carboxamide
  参考文献：
  名称：

  Synthesis and antinephritic activities of quinoline-3-carboxamides and related compounds

  摘要：

  A series of linomide-related quinoline-3-carboxamides and their analogues was prepared and evaluated for antinephritic activities. The 6-MeS derivative 7a was highly effective in two nephritis models, namely chronic graft-versus-host disease and autoimmune MRL/1 mice. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00671-0
• 作为产物：
  描述：

  5-氯-2-硝基苯甲酸 在 sodium sulfide 、 sodium hydroxide 、 三氯化铁 、 肼 作用下， 生成 6-Ethylsulfanyl-1-methyl-3,1-benzoxazine-2,4-dione
  参考文献：
  名称：

  Synthesis and antinephritic activities of quinoline-3-carboxamides and related compounds

  摘要：

  A series of linomide-related quinoline-3-carboxamides and their analogues was prepared and evaluated for antinephritic activities. The 6-MeS derivative 7a was highly effective in two nephritis models, namely chronic graft-versus-host disease and autoimmune MRL/1 mice. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00671-0