1-Isopropyl-2-methylmercapto-Δ²-imidazolin | 61682-19-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑啉类
• 英文名称: 1-Isopropyl-2-methylmercapto-Δ²-imidazolin
• 英文别名: 2-Methylthio-1-isopropyl-Δ²-imidazolin；1-Isopropyl-2-methylthio-imidazolin；1-isopropyl-2-methylmercapto-imidazoline；1-isopropyl-2-methylsulfanyl-4,5-dihydro-1H-imidazole；1-isopropyl-2-methylthio-imidazoline-2；2-Methylsulfanyl-1-propan-2-yl-4,5-dihydroimidazole
• CAS: 61682-19-7
• 化学式: C₇H₁₄N₂S
• 分子量: 158.268
• InChiKey: FERSNRQERNHBIJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.2
• 重原子数：
  10
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.86
• 拓扑面积：
  40.9
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1-Isopropyl-2-methylmercapto-Δ²-imidazolin 以100%的产率得到
  参考文献：
  名称：

  ASSEF G.; KISTER J.; METZGER J., BULL. SOC. CHIM. FRANCE, 1979, PART. 2, NO 3-4, 165-176

  摘要：

  DOI：
• 作为产物：
  描述：

  2-methylsulfanyl-3-propan-2-yl-4,5-dihydro-1H-imidazol-3-ium;iodide 、 sodium hydroxide 以92%的产率得到
  参考文献：
  名称：

  ASSEF G.; KISTER J.; METZGER J., BULL. SOC. CHIM. FRANCE, 1979, PART. 2, NO 3-4, 165-176

  摘要：

  DOI：

文献信息

• Antimalarial Activities of New Guanidylimidazole and Guanidylimidazoline Derivatives
  作者：Liang Zhang、Ramadas Sathunuru、Diana Caridha、Brandon Pybus、Michael T. O’Neil、Michael P. Kozar、Ai J. Lin

  DOI：10.1021/jm200503s

  日期：2011.10.13

  A series of new guanidylimidazole derivatives was prepared and evaluated in mice and Rhesus monkeys infected with malarial sporozoites. The majority of the new compounds showed poor metabolic stability and weak in vitro activities in three clones of Plasmodium falciparum. Compounds 8a, 8h, 9a, 16a, and 16e cured the mice infected with sporozoites of P. berghei at 160 and 320 mg/kg/day x 3 po. Compounds 8a showed better causal prophylactic activity than primaquine, tafenoquine, and Malarone in the Rhesus test. In the radical curative test, 8a cured one monkey and delayed relapse of another for 74 days at 30 mg/kg/day x 7 by im. By oral dosing, 8a delayed relapse 81 days for one and 32 days for other vs 11-12 days for control monkeys treated with 10 mg/kg of chloroquine by po alone. Compound 8h, which showed superior activity to 8a in mouse test, delayed the relapse of treated monkeys for 21-26 days at 30 mg/kg/day x 7 by oral.
• [EN] GUANIDYLIMIDAZOLE AND GUANIDYLIMIDAZOLINE DERIVATIVES AS ANTIMALARIAL AGENTS, SYNTHESIS OF AND METHODS OF USE THEREOF<br/>[FR] DÉRIVÉS DE GUANIDYLIMIDAZOLE ET DE GUANIDYLIMIDAZOLINE EN TANT QU'AGENTS ANTI-MALARIA, LEUR SYNTHÈSE ET LEURS PROCÉDÉS D'UTILISATION
  申请人：US OF AMERICA AS REPRESENTED BY THE SECRETARY OF ARMY

  公开号：WO2012149097A2

  公开（公告）日：2012-11-01

  The present invention relates to new guanidylimidazole derivatives and guanidylimidazoline derivatives, methods of making these compounds, compositions containing the same, and methods of using the same to prevent, treat, or inhibit malaria in a subject.
• ASSEF G.; KISTER J.; METZGER J., BULL. SOC. CHIM. FRANCE, 1979, PART. 2, NO 3-4, 165-176
  作者：ASSEF G.、 KISTER J.、 METZGER J.

  DOI：——

  日期：——