7-氨基-噻唑并[5,4-d]嘧啶-2(1H)-硫酮 | 6314-20-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 1,3-噻唑并[5,4-d]嘧啶
• 中文名称: 7-氨基-噻唑并[5,4-d]嘧啶-2(1H)-硫酮
• 英文名称: 7-amino-1H-thiazolo[5,4-d]pyrimidine-2-thione
• 英文别名: 7-Amino-thiazolo<5,4-d>pyrimidin-thiol-(2)；7-Amino-thiazolo<5.4-d>pyrimidin-2-thiol；7-Amino[1,3]thiazolo[5,4-d]pyrimidine-2(1H)-thione；7-amino-1H-[1,3]thiazolo[5,4-d]pyrimidine-2-thione
• CAS: 6314-20-1
• 化学式: C₅H₄N₄S₂
• 分子量: 184.246
• InChiKey: ARYGCVIPZPAANB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  11
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  121
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  7-氨基-噻唑并[5,4-d]嘧啶-2(1H)-硫酮 在 三乙基硅烷 、 甲酸 、 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 生成
  参考文献：
  名称：

  Discovery and structure-activity relationship of a series of 1-carba-1-dethiacephems exhibiting activity against methicillin-resistant Staphylococcus aureus

  摘要：

  The synthesis and antimicrobial activity of several new 1-carba-1-dethiacephalosporins is described. The discovery of unique activity of some of the analogues against methicillin-resistant Staphylococcus aureus led to the development of a structure-activity relationship designed to optimize this activity. The results of this investigation along with the pharmacokinetic select compounds are described.

  DOI：

  10.1021/jm00066a006
• 作为产物：
  描述：

  二硫化碳 、 6-benzylsulfanyl-pyrimidine-4,5-diamine 在 N,N-二甲基甲酰胺 作用下， 生成 7-氨基-噻唑并[5,4-d]嘧啶-2(1H)-硫酮
  参考文献：
  名称：

  The Use of N,N-Dimethylformamide in the Carbon Disulfide Ring Closure of 4,5-Diaminopyrimidines²

  摘要：

  DOI：

  10.1021/jo01067a089

文献信息

• Antidepressive substituted N-[(4-piperidinyl)alkyl] bicyclic condensed
  申请人：Janssen Pharmaceutica N.V.

  公开号：US04689330A1

  公开（公告）日：1987-08-25

  Novel substituted N-[(4-piperidinyl)alkyl] bicyclic condensed oxazol- and thiazolamines useful as anti-depressives, in the treatment of Parkinson's disease and in the treatment of diseases related with disturbed enterokinesia.

  这句话的中文翻译为：新型替代N-[(4-哌啶基)烷基]双环缩合噁唑和噻唑胺，可用作抗抑郁药物，治疗帕金森病和与肠动力紊乱有关的疾病的药物。
• Discovery and structure-activity relationship of a series of 1-carba-1-dethiacephems exhibiting activity against methicillin-resistant Staphylococcus aureus
  作者：Robert J. Ternansky、Susan E. Draheim、Andrew J. Pike、F. William Bell、Sarah J. West、Christopher L. Jordan、C. Y. Ernie Wu、David A. Preston、William Alborn

  DOI：10.1021/jm00066a006

  日期：1993.7

  The synthesis and antimicrobial activity of several new 1-carba-1-dethiacephalosporins is described. The discovery of unique activity of some of the analogues against methicillin-resistant Staphylococcus aureus led to the development of a structure-activity relationship designed to optimize this activity. The results of this investigation along with the pharmacokinetic select compounds are described.
• The Use of N,N-Dimethylformamide in the Carbon Disulfide Ring Closure of 4,5-Diaminopyrimidines²
  作者：RUDOLF W. BALSIGER、ALAN L. FIKES、THOMAS P. JOHNSTON、JOHN A. MONTGOMERY

  DOI：10.1021/jo01067a089

  日期：1961.9