7-amino-4-benzyl-3H-imidazo<2,3-c>-1,2,6-thiadiazine 5,5-dioxide | 78222-40-9

• 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: 7-amino-4-benzyl-3H-imidazo<2,3-c>-1,2,6-thiadiazine 5,5-dioxide
• 英文别名: 7-amino-4-benzyl-3H-imidazo[2,3-c]-1,2,6-thiadiazine 5,5-dioxide；1-benzyl-2,2-dioxo-5H-imidazo[4,5-c][1,2,6]thiadiazin-4-amine
• CAS: 78222-40-9
• 化学式: C₁₁H₁₁N₅O₂S
• 分子量: 277.307
• InChiKey: KOAOOEUMUAECSK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.3
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  113
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  阿昔洛韦侧链 、 7-amino-4-benzyl-3H-imidazo<2,3-c>-1,2,6-thiadiazine 5,5-dioxide 在 六甲基二硅氮烷 、 三氟化硼乙醚 作用下， 以 吡啶 、 二氯甲烷 为溶剂， 反应 2.0h， 以11%的产率得到7-[(2-acetoxyethoxy)methyl]-4-amino-1-benzyl-imidazo[4,5-c]-1,2,6-thiadiazine 2,2-dioxide
  参考文献：
  名称：

  Imidazothiadiazine dioxides: synthesis and antiviral activity

  摘要：

  A new series of imidazothiadiazine dioxides, including the first acyclonucleosides derived from this heterocycle moiety, has been synthesized. A wide-spectrum antiviral screening was performed. Some of the N-1 benzyl imidazothiadiazines and the new acyclonucleosides showed interesting anti-CMV or anti-HIV activity. These structures could be considered as new lead compounds for antiviral drug research. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0968-0896(99)00114-5
• 作为产物：
  描述：

  氯化苄 、 7-amino-1H,4H-imidazo<2,3-c><1,2,6>thiadiazine 5,5-dioxide 在 alkali 作用下， 生成 7-amino-4-benzyl-3H-imidazo<2,3-c>-1,2,6-thiadiazine 5,5-dioxide
  参考文献：
  名称：

  Goya, Pilar; Ochoa, Carmen; Stud, Manfred, Heterocycles, 1981, vol. 16, # 4, p. 525 - 528

  摘要：

  DOI：

文献信息

• Breining, Tibor; Cimpoia, Alex R.; Mansour, Tarek S., Heterocycles, 1995, vol. 41, # 1, p. 87 - 94
  作者：Breining, Tibor、Cimpoia, Alex R.、Mansour, Tarek S.、Cammack, Nick、Hopewell, Philippa、Ashman, Claire

  DOI：——

  日期：——
• GOYA P.; OCHOA C.; STUD M., HETEROCYCLES, 1981, 16, NO 4, 525-528
  作者：GOYA P.、 OCHOA C.、 STUD M.

  DOI：——

  日期：——
• Goya, Pilar; Ochoa, Carmen; Stud, Manfred, Heterocycles, 1981, vol. 16, # 4, p. 525 - 528
  作者：Goya, Pilar、Ochoa, Carmen、Stud, Manfred

  DOI：——

  日期：——
• Imidazothiadiazine dioxides: synthesis and antiviral activity
  作者：Ana Martı́nez、Ana I Esteban、Angela Herrero、Carmen Ochoa、Graciela Andrei、Robert Snoeck、Jan Balzarini、Erik De Clercq

  DOI：10.1016/s0968-0896(99)00114-5

  日期：1999.8

  A new series of imidazothiadiazine dioxides, including the first acyclonucleosides derived from this heterocycle moiety, has been synthesized. A wide-spectrum antiviral screening was performed. Some of the N-1 benzyl imidazothiadiazines and the new acyclonucleosides showed interesting anti-CMV or anti-HIV activity. These structures could be considered as new lead compounds for antiviral drug research. (C) 1999 Elsevier Science Ltd. All rights reserved.