4-amino-6-methyl-3-methylthio-1,2,4-triazin-5-thione | 61609-93-6

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 4-amino-6-methyl-3-methylthio-1,2,4-triazin-5-thione
• 英文别名: 4-amino-6-methyl-3-methylsulfanyl-4,5-dihydro-1,2,4-triazine-5-thione；4-Amino-6-methyl-3-(methylsulfanyl)-1,2,4-triazine-5(4H)-thione；4-amino-6-methyl-3-methylsulfanyl-1,2,4-triazine-5-thione
• CAS: 61609-93-6
• 化学式: C₅H₈N₄S₂
• 分子量: 188.277
• InChiKey: URUAURKPSBOQNB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.4
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  111
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  4-amino-6-methyl-3-methylthio-1,2,4-triazin-5-thione 在 盐酸 作用下， 反应 2.0h， 以75%的产率得到4-amino-6-methyl-1,2,4-triazin-5-thion-3-one
  参考文献：
  名称：

  Heravi, Majid M.; Rajabzadeh, Ghadir; Rahimizadeh, Mohammad, Phosphorus, Sulfur and Silicon and the Related Elements, 2001, vol. 175, p. 193 - 198

  摘要：

  DOI：
• 作为产物：
  描述：

  4-氨基-6-甲基-3-(甲硫基)-1,2,4-三嗪-5(4H)-酮 在 tetraphosphorus decasulfide 、 silica gel 作用下， 反应 0.25h， 以70%的产率得到4-amino-6-methyl-3-methylthio-1,2,4-triazin-5-thione
  参考文献：
  名称：

  THIATION OF HETEROCYCLES USING SILICA GEL SUPPORTED P₂S₅UNDER MICROWAVE IRRADIATION IN SOLVENTLESS SYSTEM

  摘要：

  The efficient and environmentally friendly thiation of hetero-cycles Using P2S5 under microwave irradiation in solvent free condition is described.

  DOI：

  10.1081/scc-100104819

文献信息

• Deamination of Some N-Amino Nitrogen Heterocycles Using Preyssler’s Anion
  作者：Majid M. Heravi、Sodeh Sadjadi、Rahim Hekmatshoar、Hossein A. Oskooie、Fatemeh F. Bamoharram

  DOI：10.1007/s00706-007-0715-1

  日期：2008.2

  Some N-aminotriazines and -triazoles were treated with Preyssler's anion as catalyst in acetic acid to afford the corresponding deaminated triazines and triazoles. The reaction is suggested to proceed via formation of N-nitrosamines with subsequent N-NO bond cleavage.
• Synthesis of a novel heterocyclic system—7-methyl-1,2-dihydro-[1,2,4]triazino[3,4-b][1,2,4,5]tetrazine-6-thione
  作者：M. M. Heravi、M. Bakavoli、M. Rahimizadeh、G. Rajabzadeh、M. Ghassemzadeh

  DOI：10.1134/s1070428008080216

  日期：2008.8

  4-Amino-6-methyl-3-hydrazino-4,5-dihydro-1,2,4-triazine-5-thione reacted with triethyl ortho-formate or triethyl orthoaceate in ethanol to give a novel heterocyclic system, [1,2,4]triazino[3,4-b][1,2,4,5]-tetrazine-6-thione.