4-Anilino-1-phenyl-2-phenylimino-5-thioxo-Δ³-imidazolin

• 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: 4-Anilino-1-phenyl-2-phenylimino-5-thioxo-Δ³-imidazolin
• 英文别名: 5-Anilino-3-phenyl-2-phenyliminoimidazole-4-thione
• 化学式: C₂₁H₁₆N₄S
• 分子量: 356.451
• InChiKey: SGASNBJQJIIQBG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  26
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  72.1
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  bis(phenylimidoyl)chloride 、 苯基硫脲 在 三乙胺 作用下， 反应 2.0h， 以76%的产率得到2-imino-1,3-diphenyl-5-(phenylimino)-4-imidazolidinethione
  参考文献：
  名称：

  1,3-Acylumlagerungen bei der Cyclisierung von Thioharnstoffen mit Imidoylchloriden der Oxals�ure - Ein Zugang zu interessanten Thiocarbonylsystemen

  摘要：

  By cycloacylation of various substituted thioureas with bis-imidochlorides of oxalic acid the new thiazolidines 3, 4 and isomeric imidazolidines 5, 6 are obtained. Especially when triethylamine is used as a base the main products are the deeply coloured 4-arylimino-5-thioxo-imidazolidines which can be regarded as s-cis-configurated 1,4-dihetero-1,3-dienes. Some thiazolidines can be rearranged by means of anhydrous organic acids to parabanic acid derivatives; whereas the 5-thioxo-imidazolidines result from an intramolecular 1,3-acyl rearrangement during the reaction.

  DOI：

  10.1002/prac.19923340711

文献信息

• [EN] IMIDAZOLE DERIVATIVES FOR USE IN THE TREATMENT OF DISEASES ASSOCIATED WITH CELL CYCLE DYSREGULATION<br/>[FR] DÉRIVÉS D'IMIDAZOLE POUR UTILISATION DANS LE TRAITEMENT DE MALADIES ASSOCIÉES À UNE DÉRÉGULATION DU CYCLE CELLULAIRE
  申请人：UNIV OF PATRAS

  公开号：WO2017203303A1

  公开（公告）日：2017-11-30

  The present invention provides imidazole derivatives according to formula (I), their enantiomers, stereoisomers, salts and hydrites thereof, for use in the treatment of diseases associated with cell cycle dysregulation, wherein R1, R2, R3, R4, R5, R7 and R8 are as defined in the claims. Also provided for use in the treatment of said diseases are pharmaceutical compositions comprising the compounds of the present invention in combination with one or more pharmaceutically acceptable carriers, solvents or excipients. Said diseases that are associated with cell cycle dysregulation are selected, among others, from a group comprising cancer, hamartoma, inflammatory disease, haematological disorder, viral disease with the potential of inducing carcinogenesis, metabolic disorder, progeroid syndrome, atherosclerosis, and vasculoproliferative disorder.
• 1,3-Acylumlagerungen bei der Cyclisierung von Thioharnstoffen mit Imidoylchloriden der Oxals�ure - Ein Zugang zu interessanten Thiocarbonylsystemen
  作者：R. Beckert、M. Gruner

  DOI：10.1002/prac.19923340711

  日期：——

  By cycloacylation of various substituted thioureas with bis-imidochlorides of oxalic acid the new thiazolidines 3, 4 and isomeric imidazolidines 5, 6 are obtained. Especially when triethylamine is used as a base the main products are the deeply coloured 4-arylimino-5-thioxo-imidazolidines which can be regarded as s-cis-configurated 1,4-dihetero-1,3-dienes. Some thiazolidines can be rearranged by means of anhydrous organic acids to parabanic acid derivatives; whereas the 5-thioxo-imidazolidines result from an intramolecular 1,3-acyl rearrangement during the reaction.