2-acetyl-N-(3,4-dichlorophenyl)hydrazinecarbothioamide | 438012-15-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-acetyl-N-(3,4-dichlorophenyl)hydrazinecarbothioamide
• 英文别名: 1-acetamido-3-(3,4-dichlorophenyl)thiourea
• CAS: 438012-15-8
• 化学式: C₉H₉Cl₂N₃OS
• 分子量: 278.162
• InChiKey: JMHFROCMVGOJRO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  16
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  85.2
• 氢给体数：
  3
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-acetyl-N-(3,4-dichlorophenyl)hydrazinecarbothioamide 、 对联苯磺酰氯 在 polymer-supported 1,3,2-diazaphosphorinane derivative 作用下， 反应 0.33h， 以90%的产率得到
  参考文献：
  名称：

  The rapid preparation of 2-aminosulfonamide-1,3,4-oxadiazoles using polymer-supported reagents and microwave heating

  摘要：

  Herein, we report on the preparation of a library of 5-substituted-2-amino-1,3,4-oxadiazoles and the corresponding thiadiazole analogues. Presented is a one-pot preparation of the 2-ammosulfonylated analogues through a three component coupling of an acylhydrazine, an isocyanate and sulfonyl chloride promoted by a polymer-supported phosphazine base under microwave dielectric heating. Also described is the optimization process and details pertaining to the elucidation of the reaction products. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2005.03.062
• 作为产物：
  描述：

  3,4-二氯苯胺 在 三乙胺 作用下， 以 四氢呋喃 、 乙醇 为溶剂， 生成 2-acetyl-N-(3,4-dichlorophenyl)hydrazinecarbothioamide
  参考文献：
  名称：

  Synthesis and anti-prion aggregation activity of acylthiosemicarbazide analogues

  摘要：

  DOI：

  10.1080/14756366.2023.2191164

文献信息

• 세미카바자이드 유도체 화합물 또는 이의 약학적으로 허용가능한 염을 포함하는 프리온 질환의 예방 또는 치료용 약학적 조성물
  申请人：한양대학교 에리카산학협력단

  公开号：KR20230066192A

  公开（公告）日：2023-05-15

  본 발명은 세미카바자이드 유도체 또는 이의 약학적으로 허용가능한 염을 유효성분으로 포함하는 프리온 질환의 예방 또는 치료용 약학적 조성물에 관한 것으로, 화학식 1로 표시되는 세미카바자이드 유도체 또는 이의 약학적으로 허용가능한 염은 프리온 단백질의 응집을 억제하는 효과가 탁월하여 프리온 단백질 PrPsc의 응집체가 야기하는 질환의 예방 및 치료용 약물로서 유용하게 사용될 수 있다.

  本发明涉及一种用于预防或治疗朊病毒病的药学组合物，所述组合物包含式I表示的半卡巴腙衍生物或其药学上可接受的盐作为有效成分。式I表示的半卡巴腙衍生物或其药学上可接受的盐能够优异地抑制朊蛋白的聚集，从而可有效地用作预防和治疗由朊蛋白PrPsc聚集体引起的疾病的药物。
• The rapid preparation of 2-aminosulfonamide-1,3,4-oxadiazoles using polymer-supported reagents and microwave heating
  作者：Ian R. Baxendale、Steven V. Ley、Marisa Martinelli

  DOI：10.1016/j.tet.2005.03.062

  日期：2005.5

  Herein, we report on the preparation of a library of 5-substituted-2-amino-1,3,4-oxadiazoles and the corresponding thiadiazole analogues. Presented is a one-pot preparation of the 2-ammosulfonylated analogues through a three component coupling of an acylhydrazine, an isocyanate and sulfonyl chloride promoted by a polymer-supported phosphazine base under microwave dielectric heating. Also described is the optimization process and details pertaining to the elucidation of the reaction products. (c) 2005 Elsevier Ltd. All rights reserved.
• Synthesis and anti-prion aggregation activity of acylthiosemicarbazide analogues
  作者：Dong Hwan Kim、Jaehyeon Kim、Hakmin Lee、Dongyun Lee、So Myoung Im、Ye Eun Kim、Miryeong Yoo、Yong-Pil Cheon、Jason C. Bartz、Young-Jin Son、Eun-Kyoung Choi、Yong-Sun Kim、Jae-Ho Jeon、Hyo Shin Kim、Sungeun Lee、Chongsuk Ryou、Tae-gyu Nam

  DOI：10.1080/14756366.2023.2191164

  日期：2023.12.31