5-benzylthio-2-phenyl-1,3,4-thiadiazole | 93141-03-8

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 5-benzylthio-2-phenyl-1,3,4-thiadiazole
• 英文别名: 2-Benzyl-mercapto-5-phenyl-1,3,4-thiadiazol；2-benzylsulfanyl-5-phenyl-[1,3,4]thiadiazole；benzylmercapto-phenyl-[1,3,4]thiadiazole；Benzylmercapto-phenyl-[1,3,4]thiadiazol；2-(benzylthio)-5-phenyl-1,3,4-thiadiazole；2-Benzylsulfanyl-5-phenyl-1,3,4-thiadiazole
• CAS: 93141-03-8
• 化学式: C₁₅H₁₂N₂S₂
• 分子量: 284.406
• InChiKey: CROHDGVJTBVVNY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  19
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  79.3
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  5-benzylthio-2-phenyl-1,3,4-thiadiazole 在 potassium permanganate 、 溶剂黄146 作用下， 生成 phenyl-phenylmethanesulfonyl-[1,3,4]thiadiazole
  参考文献：
  名称：

  Fujii et al., Yakugaku Zasshi/Journal of the Pharmaceutical Society of Japan, 1954, vol. 74, p. 1049

  摘要：

  DOI：
• 作为产物：
  描述：

  1-Thiobenzoyl-thiosemicarbazid 在 盐酸 、 碳酸氢钠 作用下， 生成 5-benzylthio-2-phenyl-1,3,4-thiadiazole
  参考文献：
  名称：

  299.一些硫代苯甲酰胺基化合物的环化

  摘要：

  DOI：

  10.1039/jr9570001556

文献信息

• Heterocyclic inhibitors of glycine transporter 2
  申请人：——

  公开号：US20030073726A1

  公开（公告）日：2003-04-17

  Compounds, compositions, and methods for inhibiting the glycine transporter 2 and for inhibiting glycine transporter mediated neuronal activity. These compounds are particularly useful for treating diseases of the nerve and muscle, including psychoses, pain, epilepsy, neurodegenerative diseases, stroke, head trauma, multiple sclerosis and the like, and of muscle disorders, including diseases or conditions associated with increased muscle contraction, such as spasticity and myoclonus. In addition, the compounds may be used to discover other agents with improved activity in assays in which the compounds of the invention are active.

  用于抑制甘氨酸转运蛋白2和抑制甘氨酸转运蛋白介导的神经活动的化合物、组合物和方法。这些化合物特别适用于治疗神经和肌肉疾病，包括精神病、疼痛、癫痫、神经退行性疾病、中风、头部创伤、多发性硬化等，以及肌肉疾病，包括与肌肉过度收缩相关的疾病或症状，如痉挛和肌阵挛。此外，这些化合物可用于发现在这些化合物具有活性的检测中具有改进活性的其他药物。
• Synthesis and Characterization of Some Thiadiazole Compounds as New Corrosion Inhibitors for Mild Steel in Cooling Water
  作者：Ekhlas Qanber Jasim、M.A. Munther Abduljaleel、Rajaa Hussein Fayadh

  DOI：10.14233/ajchem.2017.20658

  日期：——

  In present work, five 1,3,4-thiadiazole compounds were synthesized. The prepared compounds were identified by CHNS analysis, FT-IR and 1H NMR spectroscopy. The corrosion rates in the presence of thiadiazole as a steel corrosion inhibitor in the cooling water system which taken from South Fertilizer Company, Basra, Iraq were measured by the weight loss method and potentiodynamic polarization measurements. The weight loss method was studied in different times (1-5 h) and in 303 to 333 K temperature range. Results obtained revealed that thiadiazole compounds performed as a corrosion inhibitor for mild steel in this medium and its efficiency attains to 86.55 % at 5 × 10-3 M at 303 K and by potentiodynamic polarization measurements its efficiency attains to 85.35 % in the same conditions. The apparent activation energies, enthalpies and entropies of the dissolution process and the free energies were determined and discussed.

  本研究合成了五个 1,3,4-噻二唑化合物。所制备的化合物通过 CHNS 分析、傅立叶变换红外光谱和 1H NMR 光谱进行了鉴定。采用失重法和电位极化测量法测量了噻二唑作为钢材缓蚀剂存在时伊拉克巴士拉南部化肥公司冷却水系统的腐蚀速率。失重法在不同的时间（1-5 小时）和 303 至 333 K 的温度范围内进行了研究。结果表明，噻二唑化合物在这种介质中可作为低碳钢的缓蚀剂，当 5 × 10-3 M 的噻二唑化合物在 303 K 时，其效率达到 86.55%；通过电位极化测量，在相同条件下，其效率达到 85.35%。测定并讨论了溶解过程的表观活化能、焓和熵以及自由能。
• COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS
  申请人：THE BROAD INSTITUTE, INC.

  公开号：US20160031870A1

  公开（公告）日：2016-02-04

  Disclosed are compounds that can be used for treating tuberculosis.

  本发明涉及用于治疗结核病的化合物。
• Compounds for the treatment of tuberculosis
  申请人：THE BROAD INSTITUTE, INC.

  公开号：US10301294B2

  公开（公告）日：2019-05-28

  Disclosed are compounds that can be used for treating tuberculosis.

  所公开的是可用于治疗结核病的化合物。
• The Cyclization of 3-Acyldithiocarbazate Esters¹
  作者：Richard W. Young、Kathryn H. Wood

  DOI：10.1021/ja01607a051

  日期：1955.1