N-{4-[bis(2-methylpropyl)sulfamoyl]phenyl}acetamide | 101447-04-5

• 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: N-{4-[bis(2-methylpropyl)sulfamoyl]phenyl}acetamide
• 英文别名: N-[4-[bis(2-methylpropyl)sulfamoyl]phenyl]acetamide
• CAS: 101447-04-5
• 化学式: C₁₆H₂₆N₂O₃S
• mdl: MFCD00577472
• 分子量: 326.46
• InChiKey: KXRUUOIJAQDSPT-UHFFFAOYSA-N

物化性质

• 熔点：
  137-138 °C(Solv: ethyl acetate (141-78-6))
• 密度：
  1.134±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  22
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  74.9
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  N-{4-[bis(2-methylpropyl)sulfamoyl]phenyl}acetamide 在 盐酸 作用下， 以 乙醇 为溶剂， 生成 4-Amino-N,N-diisobutylbenzenesulfonamide
  参考文献：
  名称：

  4-Sulfonamidoanilide tertiary carbinols: A novel series of potassium channel openers

  摘要：

  Sulfonamides are viable replacements for the phenylsulfonyl acid benzoyl moieties initially described for the anilide tertiary carbinol series of K-ATP potassium channel openers. The SAR of this new series and the synthetic chemistry employed to generate its members are described. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(97)00111-x
• 作为产物：
  描述：

  二异丁胺 、 对乙酰胺基苯磺酰氯 在 4-二甲氨基吡啶 作用下， 以 乙腈 为溶剂， 生成 N-{4-[bis(2-methylpropyl)sulfamoyl]phenyl}acetamide
  参考文献：
  名称：

  4-Sulfonamidoanilide tertiary carbinols: A novel series of potassium channel openers

  摘要：

  Sulfonamides are viable replacements for the phenylsulfonyl acid benzoyl moieties initially described for the anilide tertiary carbinol series of K-ATP potassium channel openers. The SAR of this new series and the synthetic chemistry employed to generate its members are described. (C) 1997 Elsevier Science Ltd.

  DOI：

  10.1016/s0960-894x(97)00111-x

文献信息

• 4-Sulfonamidoanilide tertiary carbinols: A novel series of potassium channel openers
  作者：J.R. Empfield、D. Mayhugh、C.J. Ohnmacht、C.A. Frank、T. Grant、J. Li

  DOI：10.1016/s0960-894x(97)00111-x

  日期：1997.1

  Sulfonamides are viable replacements for the phenylsulfonyl acid benzoyl moieties initially described for the anilide tertiary carbinol series of K-ATP potassium channel openers. The SAR of this new series and the synthetic chemistry employed to generate its members are described. (C) 1997 Elsevier Science Ltd.