4-methylamino-6-dimethyldithiocarbamoyl-5-nitropyrimidine | 959354-74-6

• 分子结构分类: 有机化合物 - 有机1,3-偶极化合物 - 烯丙基型1,3-偶极有机化合物
• 英文名称: 4-methylamino-6-dimethyldithiocarbamoyl-5-nitropyrimidine
• 英文别名: 6-(methylamino)-N,N-bis(methylsulfanyl)-5-nitro-pyrimidine-4-carbothioamide；6-(methylamino)-N,N-bis(methylsulfanyl)-5-nitropyrimidine-4-carbothioamide
• CAS: 959354-74-6
• 化学式: C₈H₁₁N₅O₂S₃
• 分子量: 305.406
• InChiKey: PROUVNMLVRGWKU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  18
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  170
• 氢给体数：
  1
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  6-氯-N-甲基-5-硝基-4-嘧啶胺 、 sodium N,N-dimethyldithiocarbamate dihydrate 以 乙醇 、 丙酮 为溶剂， 生成 4-methylamino-6-dimethyldithiocarbamoyl-5-nitropyrimidine
  参考文献：
  名称：

  Dithiocarbamate derivatives and their use as antibacterial agents

  摘要：

  式I的化合物，其中X是从所述群组中选择的二价残基，具有出色的抗菌活性，并且是治疗或预防哺乳动物（人类和动物）由细菌引起的传染病的有用药剂，特别是由分枝杆菌引起的肺结核（TB）和麻风病以及由葡萄球菌引起的传染病。

  公开号：

  EP1312607A1

文献信息

• DITHIOCARBAMATE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS
  申请人：MedacGesellschaft für klinischeSpezialpräparate mbH

  公开号：EP1448533A1

  公开（公告）日：2004-08-25
• [EN] DITHIOCARBAMATE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS<br/>[FR] DERIVES DE DITHIOCARBAMATE, ET LEUR UTILISATION COMME AGENTS ANTIBACTERIENS
  申请人：MEDAC KLINISCHE SPEZIALPRAEP

  公开号：WO2003042186A1

  公开（公告）日：2003-05-22

  The invention relates to the use of dithiocarbamate derivatives for the therapeutic or prophylactic treatment of infectious diseases in mammals (humans and animals) caused by bacteria, especially diseases like tuberculosis (TB) and lepra caused by mycobacteria and infectious diseases caused by staphylococci. The invention further relates to novel dithiocarbamate derivatives of the formula (I), wherein X is a bivalent residue selected from the group consisting of formulae (1, 2, 3, 4) having excellent antibacterial activities, and to pharmaceutical preparations containing the same.
• [EN] INVISIBLE INK<br/>[FR] ENCRE INVISIBLE
  申请人：NOCOPI INT INC

  公开号：WO2005037905A1

  公开（公告）日：2005-04-28

  A method of invisible ink fabrication. A first ink having an activator without a leucodye is prepared. A second ink having a leucodye is prepared without an activator, which is combined with the first ink prior to color development and prior to printing. Preferably, the combined ink is printed immediately after being created. Further disclosed are items created using the ink such as toys, puzzles, stickers, coloring books, tags, labels and security devices.