2-Phenylthio-4,5-dimethoxyaniline | 30058-48-1

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 2-Phenylthio-4,5-dimethoxyaniline
• 英文别名: 4-Phenylthio-5-amino veratrole；4,5-dimethoxy-2-phenylsulfanylaniline
• CAS: 30058-48-1
• 化学式: C₁₄H₁₅NO₂S
• mdl: MFCD26207847
• 分子量: 261.345
• InChiKey: PZLLWXIVUKYUNF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.3
• 重原子数：
  18
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.142
• 拓扑面积：
  69.8
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  2-Phenylthio-4,5-dimethoxyaniline 在 N,N-二甲基苯胺 作用下， 以 甲苯 、 乙腈 为溶剂， 反应 24.0h， 生成 3-(4,5-Dimethoxy-2-phenylsulfanyl-phenyl)-1,1-diethyl-urea
  参考文献：
  名称：

  Synthesis and blood pressure lowering activity of 3-(substituted-amino)-1,2,4-benzothiadiazine 1-oxide derivatives

  摘要：

  A series of (substituted amino)-1,2,4-benzothiadiazine 1-oxides has been synthesized and most members of the series have been shown to have blood pressure lowering effects in normotensive rabbits and in spontaneously hypertensive rats. The most active member of the series was 3-[4-(2-furoyl)-1-piperazinyl]-6,7-dimethoxy-1-methyl-1H-1,2,4-benzothiadiazine 1-oxide hydrochloride. This compound in animal tests was equipotent to the known antihypertensive Prazosin.

  DOI：

  10.1021/jm00181a003
• 作为产物：
  描述：

  4-溴-5-硝基藜芦醚 在 盐酸 、 tin 、 sodium methylate 作用下， 以 甲醇 、 乙醇 为溶剂， 生成 2-Phenylthio-4,5-dimethoxyaniline
  参考文献：
  名称：

  抗疟疾2-溴-N，N-双（二乙基氨基乙基）-4,5-二甲氧基苯胺的类似物。2位置变化。

  摘要：

  DOI：

  10.1021/jm00300a021

文献信息

• Analogs of the antimalarial 2-bromo-N,N-bis(diethylaminoethyl)-4,5-dimethoxyaniline. 2-Position variations
  作者：Eugene L. Stogryn

  DOI：10.1021/jm00300a021

  日期：1970.11
• DILLARD R. D.; YEN T. T.; STARK P.; PAVEY D. E., J. MED. CHEM., 1980, 23, NO 7, 717-722
  作者：DILLARD R. D.、 YEN T. T.、 STARK P.、 PAVEY D. E.

  DOI：——

  日期：——
• US4171361A
  申请人：——

  公开号：US4171361A

  公开（公告）日：1979-10-16
• Synthesis and blood pressure lowering activity of 3-(substituted-amino)-1,2,4-benzothiadiazine 1-oxide derivatives
  作者：Robert D. Dillard、Terence T. Yen、Paul Stark、Donald E. Pavey

  DOI：10.1021/jm00181a003

  日期：1980.7

  A series of (substituted amino)-1,2,4-benzothiadiazine 1-oxides has been synthesized and most members of the series have been shown to have blood pressure lowering effects in normotensive rabbits and in spontaneously hypertensive rats. The most active member of the series was 3-[4-(2-furoyl)-1-piperazinyl]-6,7-dimethoxy-1-methyl-1H-1,2,4-benzothiadiazine 1-oxide hydrochloride. This compound in animal tests was equipotent to the known antihypertensive Prazosin.