methyl 2-[amino(pyridin-3-yl)methylidene]hydrazinecarbodithioate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: methyl 2-[amino(pyridin-3-yl)methylidene]hydrazinecarbodithioate
• 英文别名: methyl N-[(E)-[amino(pyridin-3-yl)methylidene]amino]carbamodithioate
• 化学式: C₈H₁₀N₄S₂
• 分子量: 226.326
• InChiKey: NXIZKOWBJZUQPY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  14
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  121
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  methyl 2-[amino(pyridin-3-yl)methylidene]hydrazinecarbodithioate 在 盐酸 作用下， 反应 0.08h， 以91%的产率得到3-(5-methylsulfanyl-[1,3,4]thiadiazol-2-yl)-pyridine
  参考文献：
  名称：

  Reactivity of N ¹-Dithioester Substituted Pyridinand Pyrazincarboxamidrazones

  摘要：

  The N1-dithioester substituted pyridin- and pyrazincarboxamidrazones underwent cyclocondensation to 5-methylsulfanyl-1,3,4-thiadiazole or 1,2,4-triazole derivatives, depending on the reaction conditions. With an excess of secondary amines, pyrazincarboxamidrazone dithioester gave 5-amino-1,3,4-thiadiazoles and with an ethanoloamine a 1,2,4-triazole derivative. Prepared compounds were evaluated as potential tuberculostatic agents, but the minimum inhibitory concentrations values indicated no significant activity.

  DOI：

  10.1080/10426500500270065
• 作为产物：
  描述：

  肼基二硫代甲酸甲酯 、 nicotinic acid ethyl imino ester 以 甲醇 为溶剂， 反应 1.0h， 以80%的产率得到methyl 2-[amino(pyridin-3-yl)methylidene]hydrazinecarbodithioate
  参考文献：
  名称：

  Orlewska; Foks; Sowinski, Polish Journal of Chemistry, 2001, vol. 75, # 9, p. 1237 - 1245

  摘要：

  DOI：

文献信息

• Orlewska; Foks; Sowinski, Polish Journal of Chemistry, 2001, vol. 75, # 9, p. 1237 - 1245
  作者：Orlewska、Foks、Sowinski、Martynowski、Olczak、Glowka

  DOI：——

  日期：——
• Reactivity of <i>N</i> ¹-Dithioester Substituted Pyridinand Pyrazincarboxamidrazones
  作者：Czeslawa Orlewska、Danuta Pancechowska-Ksepko、Henryk Foks、Zofia Zwolska、Ewa Augustynowicz-Kopec

  DOI：10.1080/10426500500270065

  日期：2006.4.1

  The N1-dithioester substituted pyridin- and pyrazincarboxamidrazones underwent cyclocondensation to 5-methylsulfanyl-1,3,4-thiadiazole or 1,2,4-triazole derivatives, depending on the reaction conditions. With an excess of secondary amines, pyrazincarboxamidrazone dithioester gave 5-amino-1,3,4-thiadiazoles and with an ethanoloamine a 1,2,4-triazole derivative. Prepared compounds were evaluated as potential tuberculostatic agents, but the minimum inhibitory concentrations values indicated no significant activity.