Hydrazinecarbodithioic acid butyl ester | 26173-57-9

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫基化合物
• 英文名称: Hydrazinecarbodithioic acid butyl ester
• 英文别名: butyl N-aminocarbamodithioate
• CAS: 26173-57-9
• 化学式: C₅H₁₂N₂S₂
• mdl: MFCD19201685
• 分子量: 164.296
• InChiKey: XMEGFGKLMZOUTD-UHFFFAOYSA-N

物化性质

• 沸点：
  256.3±23.0 °C(Predicted)
• 密度：
  1.152±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  9
• 可旋转键数：
  4
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.8
• 拓扑面积：
  95.4
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  Hydrazinecarbodithioic acid butyl ester 在 双氧水 、 乙酸酐 作用下， 反应 3.0h， 生成 4-[5-(Butane-1-sulfonyl)-[1,3,4]thiadiazol-2-yl]-pyridine 1-oxide
  参考文献：
  名称：

  Kubota, Seiju; Toyooka, Kouhei; Misra, Hemant K., Journal of the Chemical Society. Perkin transactions I, 1983, # 12, p. 2957 - 2962

  摘要：

  DOI：
• 作为产物：
  描述：

  1-碘丁烷 、 二硫代碳酸单酰肼肼盐 以 乙醇 为溶剂， 生成 Hydrazinecarbodithioic acid butyl ester
  参考文献：
  名称：

  Syntheses and uncoupling activities of alkyl dithiocarbazates and alkyl pyridinecarbonyldithiocarbazates

  摘要：

  A series of alkyl dithiocarbazates, alkyl 3-picolinoyldithiocarbazates, alkyl 3-nicotinoyldithiocarbazates, alkyl 3-isonicotinoyldithiocarbazates, and alkyl 3-picolinoyl-2-methyldithiocarbazates was prepared. These alkyl pyridinecarbonyldithiocarbazates were shown to be uncouplers of oxidative phosphorylation in mitochondria. The finding that uncoupling activity increased with increase in the length of the alkyl chains of the compounds indicates that hydrophobicity influences the activity. The nonyl derivatives had the highest activity. The results also suggested that a dissociable acidic proton is necessary for the uncoupling activity.

  DOI：

  10.1021/jm00204a018

文献信息

• Novel 5-Sulfonyl-1,3,4-thiadiazole-Substituted Flavonoids as Potential Bactericides and Fungicides: Design, Synthesis, Three-Dimensional Quantitative Structure–Activity Relationship Studies
  作者：Peng Dai、Jian Jiao、Yufei Li、Peng Teng、Qingqing Wang、Yuchuan Zhu、Weihua Zhang

  DOI：10.1021/acs.jafc.3c06367

  日期：2024.3.27

  Compound 2 (EC50 = 0.41 μg/mL) displayed the most effective inhibitory potency against R. solani in vivo, comparable protective effects with the positive control carbendizam. Preliminary mechanistic studies indicated that compound 2 induced disordered entanglement of hyphae, shrinkage of hyphal surfaces, extravasation of cellular contents, and vacuole swelling and rupture, which disrupted normal hyphal

  黄酮类化合物是普遍存在的天然产物，由于其结构多样性、广谱药理活性和优异的环境相容性，为药物发现提供了来源。为了开发具有新颖作用机制和创新结构的抗菌和抗真菌药物，设计并合成了一系列新型5-磺酰基-1,3,4-噻二唑取代的黄酮类化合物，并评估了它们对七种农业常见植物病原微生物的生物活性。抗菌生物测定结果表明，大部分目标化合物对米黄单胞菌、立枯丝核菌和炭疽病菌均表现出良好的抑制作用。化合物1、3、7、9、13和14对米叶枯病菌表现出显着的抗菌活性。稻曲霉的 EC 50值低于 10 μg/mL，优于双甲噻唑 (70.89 μg/mL)。化合物2 (EC 50 = 0.41 μg/mL)在体内对立枯丝核菌表现出最有效的抑制效力，其保护作用与阳性对照多菌灵相当。初步机理研究表明，化合物2诱导菌丝无序缠结、菌丝表面收缩、细胞内容物外渗以及液泡膨胀和破裂，从而扰乱了正常菌丝生长。随后，基于可靠的三维定量构
• Syntheses and uncoupling activities of alkyl dithiocarbazates and alkyl pyridinecarbonyldithiocarbazates
  作者：Seiju Kubota、Masayuki Uda、Yasuyuki Mori、Fujio Kametani、Hiroshi Terada

  DOI：10.1021/jm00204a018

  日期：1978.6

  A series of alkyl dithiocarbazates, alkyl 3-picolinoyldithiocarbazates, alkyl 3-nicotinoyldithiocarbazates, alkyl 3-isonicotinoyldithiocarbazates, and alkyl 3-picolinoyl-2-methyldithiocarbazates was prepared. These alkyl pyridinecarbonyldithiocarbazates were shown to be uncouplers of oxidative phosphorylation in mitochondria. The finding that uncoupling activity increased with increase in the length of the alkyl chains of the compounds indicates that hydrophobicity influences the activity. The nonyl derivatives had the highest activity. The results also suggested that a dissociable acidic proton is necessary for the uncoupling activity.
• Kubota, Seiju; Toyooka, Kouhei; Misra, Hemant K., Journal of the Chemical Society. Perkin transactions I, 1983, # 12, p. 2957 - 2962
  作者：Kubota, Seiju、Toyooka, Kouhei、Misra, Hemant K.、Kawano, Michinobu、Shibuya, Masayuki

  DOI：——

  日期：——