Sulfamic acid 2-(2-amino-6-oxo-1,6-dihydro-purin-9-ylmethoxy)-ethyl ester

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 咪唑并嘧啶类
• 英文名称: Sulfamic acid 2-(2-amino-6-oxo-1,6-dihydro-purin-9-ylmethoxy)-ethyl ester
• 英文别名: 2-[(2-amino-6-oxo-1H-purin-9-yl)methoxy]ethyl sulfamate
• 化学式: C₈H₁₂N₆O₅S
• 分子量: 304.286
• InChiKey: XUTINXWCYNVZSF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -2.1
• 重原子数：
  20
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  172
• 氢给体数：
  3
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  Sulfamic acid 2-(2-benzoylamino-6-oxo-1,6-dihydro-purin-9-ylmethoxy)-ethyl ester 在 甲醇 、 氨 作用下， 反应 72.0h， 以38%的产率得到Sulfamic acid 2-(2-amino-6-oxo-1,6-dihydro-purin-9-ylmethoxy)-ethyl ester
  参考文献：
  名称：

  Synthesis and antiviral properties of novel analogues of monophosphate and diphosphate bioactive forms of acyclovir

  摘要：

  New analogues (compounds 6, 7 and 9) of the mono- (8) and diphosphate (10) bioactive forms of the antiherpes drug acyclovir are described. In compound 6, the monophosphate moiety of 8 was replaced by an aminosulfonyloxy group, while in compounds 7 and 9, a phosphonoacetamidoxy and an O-ethyl phosphonoacetamidoxy moiety are, respectively present instead of the diphosphate one of 10. None of the compounds synthesized proved to possess an appreciable activity on herpes simplex virus (HSV) or human immunodeficiency virus (HIV). (C) 2000 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0014-827x(00)00046-x

文献信息

• Synthesis and antiviral properties of novel analogues of monophosphate and diphosphate bioactive forms of acyclovir
  作者：Marco Macchia、Guido Antonelli、Simone Bertini、Federico Calvani、Valeria Di Bussolo、Filippo Minutolo、Ramon Tesoro、Imperio Tonetti、Ombretta Turriziani

  DOI：10.1016/s0014-827x(00)00046-x

  日期：2000.4

  New analogues (compounds 6, 7 and 9) of the mono- (8) and diphosphate (10) bioactive forms of the antiherpes drug acyclovir are described. In compound 6, the monophosphate moiety of 8 was replaced by an aminosulfonyloxy group, while in compounds 7 and 9, a phosphonoacetamidoxy and an O-ethyl phosphonoacetamidoxy moiety are, respectively present instead of the diphosphate one of 10. None of the compounds synthesized proved to possess an appreciable activity on herpes simplex virus (HSV) or human immunodeficiency virus (HIV). (C) 2000 Elsevier Science S.A. All rights reserved.