2-(p-nitroanilino)-4-(p-chlorophenyl)thiazole | 130235-94-8

• 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-(p-nitroanilino)-4-(p-chlorophenyl)thiazole
• 英文别名: 4-(4-chlorophenyl)-N-(4-nitrophenyl)-1,3-thiazol-2-amine
• CAS: 130235-94-8
• 化学式: C₁₅H₁₀ClN₃O₂S
• 分子量: 331.782
• InChiKey: QRBRHTVFQFVYJP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  22
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  99
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  2,4'-二氯苯乙酮 、 对硝基苯基硫脲 以 乙醇 为溶剂， 反应 4.0h， 以61%的产率得到2-(p-nitroanilino)-4-(p-chlorophenyl)thiazole
  参考文献：
  名称：

  Singh; Sehgal; Sharma, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1990, vol. 29, # 6, p. 533 - 538

  摘要：

  DOI：

文献信息

• 2-Anilino-4-aryl-1,3-thiazole inhibitors of valosin-containing protein (VCP or p97)
  作者：Matthew G. Bursavich、Daniel P. Parker、J. Adam Willardsen、Zhong-Hua Gao、Thaylon Davis、Kirill Ostanin、Rosann Robinson、Ashley Peterson、Daniel M. Cimbora、Ju-Fen Zhu、Burt Richards

  DOI：10.1016/j.bmcl.2010.01.058

  日期：2010.3

  Valosin-containing protein (VCP; also known as p97) is a member of the AAA ATPase family with a central role in the ubiquitin-degradation of misfolded proteins. VCP also exhibits antiapoptotic function and metastasis via activation of nuclear factor kappa-B signaling pathway. We have discovered that 2-anilino-4-aryl-1,3-thiazoles are potent drug-like inhibitors of this enzyme. The identified compounds show low nanomolar VCP potency, demonstrate SAR trends, and show activity in a mechanism based cellular assay. This series of compounds represents the first steps towards a novel, small molecule VCP inhibitor as a cancer therapeutic. (C) 2010 Elsevier Ltd. All rights reserved.
• SINGH, S. P.;SEHGAL, SUBHASH;SHARMA, PAWAN KUMAR, INDIAN J. CHEM., 29,(1990) N, C. 533-538
  作者：SINGH, S. P.、SEHGAL, SUBHASH、SHARMA, PAWAN KUMAR

  DOI：——

  日期：——
• Singh; Sehgal; Sharma, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1990, vol. 29, # 6, p. 533 - 538
  作者：Singh、Sehgal、Sharma

  DOI：——

  日期：——