3,3'-(1,6-hexanediyl)bis(5,5-dimethyl-2,4-imidazolinedione) | 25176-29-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑烷类
• 英文名称: 3,3'-(1,6-hexanediyl)bis(5,5-dimethyl-2,4-imidazolinedione)
• 英文别名: 3-[6-(4,4-Dimethyl-2,5-dioxoimidazolidin-1-yl)hexyl]-5,5-dimethylimidazolidine-2,4-dione
• CAS: 25176-29-8
• 化学式: C₁₆H₂₆N₄O₄
• 分子量: 338.407
• InChiKey: XEZOLQPJVQQSAG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  24
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  98.8
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  1,6-二溴己烷 、 5,5-二甲基海因 在 氢氧化钾 作用下， 以 乙醇 为溶剂， 反应 20.0h， 以42%的产率得到3,3'-(1,6-hexanediyl)bis(5,5-dimethyl-2,4-imidazolinedione)
  参考文献：
  名称：

  Chemical differentiating agents. Differentiation of HL-60 cells by hexamethylenebis[acetamide]analogs

  摘要：

  Hexamethylenebis[acetamide] (HMBA) is an agent in clinical trial that induces differentiation of certain types of tumor cells to nonmalignant phenotypes. In an attempt to discover a more potent compound, a number of bis-functionalized amides, imides, and hydrazine derivatives of HMBA were prepared and evaluated in vitro with the HL-60 human promyelocytic leukemia cell line. Among the compounds evaluated, the 5,5-dimethylhydantoin derivative is almost 10 times more potent than HMBA in inducing differentiation. The bis-imide, diacetyl-HMBA, is both more potent and effective than its parent compound. Six of the 16 compounds evaluated cause at least 20% differentiation. An inverse relationship between the degree of differentiation and the percentage of viable cells is described for HMBA and its analogues.

  DOI：

  10.1021/jm00385a025

文献信息

• DRISEOLL, JOHN S.;HACES, ALBERTE;BREITMAN, THEODORE
  作者：DRISEOLL, JOHN S.、HACES, ALBERTE、BREITMAN, THEODORE

  DOI：——

  日期：——
• HACES A.; BREITMAN T. R.; DRISCOLL J. S., J. MED. CHEM., 30,(1987) N 2, 405-409
  作者：HACES A.、 BREITMAN T. R.、 DRISCOLL J. S.

  DOI：——

  日期：——
• US3894038A
  申请人：——

  公开号：US3894038A

  公开（公告）日：1975-07-08
• US4038277A
  申请人：——

  公开号：US4038277A

  公开（公告）日：1977-07-26
• US4882346A
  申请人：——

  公开号：US4882346A

  公开（公告）日：1989-11-21