Methyl-sulfamic acid 3-nitro-phenyl ester | 54838-81-2

• 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: Methyl-sulfamic acid 3-nitro-phenyl ester
• 英文别名: (3-nitrophenyl) N-methylsulfamate
• CAS: 54838-81-2
• 化学式: C₇H₈N₂O₅S
• 分子量: 232.217
• InChiKey: IPUWYIGNIIHVTG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  110
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  甲基氨基磺酰氯 、 间硝基苯酚 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成 Methyl-sulfamic acid 3-nitro-phenyl ester
  参考文献：
  名称：

  Williams,A.; Douglas,K.T., Journal of the Chemical Society. Perkin transactions II, 1974, p. 1727 - 1732

  摘要：

  DOI：

文献信息

• Steroid sulphatase inhibitors
  申请人：Reed John Michael

  公开号：US20070021624A1

  公开（公告）日：2007-01-25

  A method of inhibiting steroid sulphatase activity in a subject in need of same is described. The method comprises administering to said subject a steroid sulphatase inhibiting amount of a ring system compound; which ring system compound comprises a ring to which is attached a sulphamate group of the formula wherein each of R 1 and R 2 is independently selected from H, alkyl, alkenyl, cycloalkyl and aryl, or together represent alkylene optionally containing one or more hetero atoms or groups in the alkylene chain; and wherein said compound is an inhibitor of an enzyme having steroid sulphatase activity (E.C.3.1.6.2); and if the sulphamate group of said compound is replaced with a sulphate group to form a sulphate compound and incubated with a steroid sulphatase enzyme (E.C.3.1.6.2) at a pH 7.4 and 37° C. it would provide a K m value of less than 50 μM.
• Williams,A.; Douglas,K.T., Journal of the Chemical Society. Perkin transactions II, 1974, p. 1727 - 1732
  作者：Williams,A.、Douglas,K.T.

  DOI：——

  日期：——