4-[[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]sulfamoyl]benzoic acid | 685508-64-9

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 4-[[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]sulfamoyl]benzoic acid
• CAS: 685508-64-9
• 化学式: C₁₃H₁₇NO₆S
• 分子量: 315.347
• InChiKey: PIFZNSSUYZSHMF-NSHDSACASA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  21
• 可旋转键数：
  7
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  118
• 氢给体数：
  2
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  4-[[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]sulfamoyl]benzoic acid 在 氯化亚砜 、 碳酸氢钠 、 三氯氧磷 作用下， 以 二氯甲烷 、 甲苯 为溶剂， 反应 5.0h， 生成
  参考文献：
  名称：

  New heteroarylbenzenesulphonamides as matrix metalloproteinase inhibitors

  摘要：

  A series of derivatives of 2,4- and 2,5-thiazolyl- or oxazolylbenzenesulphonamides has been prepared and evaluated as potential MMP inhibitors. The thiazole 15b have been found to exhibit MMP-2 and MMP-9 inhibitions higher than reference compounds GI 129471 and CGS 27023A. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2003.12.076
• 作为产物：
  描述：

  L-缬氨酸甲酯 、 4-(氯磺酰)苯甲酸 在 碳酸氢钠 作用下， 反应 3.0h， 以63%的产率得到4-[[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]sulfamoyl]benzoic acid
  参考文献：
  名称：

  New heteroarylbenzenesulphonamides as matrix metalloproteinase inhibitors

  摘要：

  A series of derivatives of 2,4- and 2,5-thiazolyl- or oxazolylbenzenesulphonamides has been prepared and evaluated as potential MMP inhibitors. The thiazole 15b have been found to exhibit MMP-2 and MMP-9 inhibitions higher than reference compounds GI 129471 and CGS 27023A. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2003.12.076

文献信息

• New heteroarylbenzenesulphonamides as matrix metalloproteinase inhibitors
  作者：Frédéric Delbecq、Guy Cordonnier、Nicole Pommery、Didier Barbry、Jean-Pierre Hénichart

  DOI：10.1016/j.bmcl.2003.12.076

  日期：2004.3

  A series of derivatives of 2,4- and 2,5-thiazolyl- or oxazolylbenzenesulphonamides has been prepared and evaluated as potential MMP inhibitors. The thiazole 15b have been found to exhibit MMP-2 and MMP-9 inhibitions higher than reference compounds GI 129471 and CGS 27023A. (C) 2004 Elsevier Ltd. All rights reserved.