5,5-二苯基-3-丙基咪唑烷-2,4-二酮 | 62053-81-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑烷类
• 中文名称: 5,5-二苯基-3-丙基咪唑烷-2,4-二酮
• 英文名称: 5,5-diphenyl-3-propyl-imidazolidine-2,4-dione
• 英文别名: 5,5-Diphenyl-3-propyl-imidazolidin-2,4-dion；5,5-Diphenyl-3-propylimidazolidine-2,4-dione
• CAS: 62053-81-0
• 化学式: C₁₈H₁₈N₂O₂
• 分子量: 294.353
• InChiKey: BOXWHQWDUBNHQB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  22
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  49.4
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  在 potassium carbonate 、 溶剂黄146 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 5,5-二苯基-3-丙基咪唑烷-2,4-二酮
  参考文献：
  名称：

  3-Alkyl-(5,5′-diphenyl)imidazolidinediones as new cannabinoid receptor ligands

  摘要：

  Twenty-four 3-alkyl-(5,5'-diphenyl)imidazolidinediones were synthesized and evaluated as new cannabinoid receptor ligands. Three compounds exhibited a Ki value around 100 nM against [H-3]-SR 141716A binding obtained from human CB1 transfected CHO cells membranes. The lack of change of affinity in the presence of a non hydrolyzable GTP analogue seems to indicate they are cannabinoid antagonists. (C) 1999 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(99)00353-4

文献信息

• Structure-activity relationships of 3-substituted-5,5- diphenylhydantoins as potential antiproliferative and antimicrobial agents
  作者：Nemanja Trisovic、Bojan Bozic、Ana Obradovic、Olgica Stefanovic、Snezana Markovic、Ljiljana Comic、Biljana Bozic、Gordana Uscumlic

  DOI：10.2298/jsc110314143t

  日期：——

  A series of twelve 3-substituted-5,5-diphenylhydantoins was synthesized, including some whose anticonvulsant activities have already been reported in the literature. Their antiproliferative activities against HCT-116 human colon carcinoma cells were evaluated to determine structure-activity relationships. Almost all of the compounds exhibited statistically significant antiproliferative effects at a concentration of 100 ?M, while the derivative bearing a benzyl group was active even at lower concentrations. Moreover, their in vitro antibacterial activities against Escherichia coli ATCC 25922, Staphylococcus aureus ATCC 25923 and clinical isolates of Escherichia coli, Proteus mirabilis, Pseudomonas aeruginosa, Enterococcus faecalis and Staphylococcus aureus were evaluated. Only the 3-iso-propyl and 3-benzyl derivatives showed weak antibacterial activities against the Gram-positive bacterium E. faecalis and the Gram-negative bacteria E. coli ATCC 25922 and E. coli.

  合成了十二种 3-取代-5,5-二苯基海因系列、 包括一些已在文献中报道过其抗惊厥活性的化合物。 文献中已有报道。评估了它们对 HCT-116 人结肠癌细胞的抗增殖活性，以确定其作用机制。 结肠癌细胞的抗增殖活性进行了评估，以确定结构-活性关系。 关系。几乎所有化合物都表现出了统计学意义上的 的抗增殖作用，而带有苄基的衍生物在浓度为 100? 而带有苄基的衍生物即使在较低浓度下也具有活性。 此外，它们在体外对大肠杆菌 大肠杆菌 ATCC 25922、金黄色葡萄球菌 ATCC 25923 和临床分离的 大肠杆菌、奇异变形杆菌、铜绿假单胞菌、粪肠球菌和葡萄球菌的体外抗菌活性。 粪肠球菌和金黄色葡萄球菌进行了评估。只有 3-异丙基和 3-苄基衍生物对革兰氏阳性菌大肠杆菌和金黄色葡萄球菌表现出微弱的抗菌活性。 革兰氏阳性菌粪肠球菌和革兰氏阴性菌大肠杆菌 ATCC 25922 和 E. coli.
• New aspects of reactions of methyl (thio)ureas with benzil
  作者：Vladimir V. Baranov、Tatyana N. Vol'khina、Yulia V. Nelyubina、Angelina N. Kravchenko

  DOI：10.1016/j.mencom.2021.09.027

  日期：2021.9

  New pathways of reaction between 1-methylthiourea or 1-methylurea and benzil bring about new derivatives of (2S*,3aR*,6aS*)-perhydro-3aH-[1,3]dioxolo[4,5-d]imidazole and racemic (4S*,5R*)-4-alkoxy-5-hydroxy-1-methyl-4,5-diphenylimidazolidine-2-thiones. Some of the obtained urea-and thiourea derivatives were characterized by X-ray diffraction, which showed their supramolecular organization governed

  1-甲基硫脲或1-甲基脲与苄基反应的新途径产生(2 S *,3a R *,6a S *)-perhydro-3a H -[1,3]dioxolo[4,5- d的新衍生物]咪唑和外消旋 (4 S *,5 R *)-4-烷氧基-5-羟基-1-甲基-4,5-二苯基咪唑烷-2-硫酮。一些获得的脲和硫脲衍生物通过 X 射线衍射表征，表明它们的超分子组织受受体侧 C=O 或 C=S 基团的氢键方向性控制。
• Oxabicycloheptanes and oxabicycloheptenes, their preparation and use
  申请人：Kovach John S.

  公开号：US20100029484A1

  公开（公告）日：2010-02-04

  This invention provides compounds having the structure which may be used for the treatment of tumors.

  这项发明提供了具有以下结构的化合物，可用于肿瘤治疗。
• Oxabicycloheptanes and Oxabicycloheptenes, Their Preparation and Use
  申请人：Kovach John S.

  公开号：US20120264764A1

  公开（公告）日：2012-10-18

  This invention provides compounds having the structure which may be used for the treatment of tumors.

  这项发明提供了具有以下结构的化合物，可用于肿瘤治疗。
• Acetylen-Aminos�uren
  作者：K. Schl�gl

  DOI：10.1007/bf00898759

  日期：——