N9-(1,1'-biphenyl)-4-yl-N1-methyl-2-oxononanediamide

• 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: N9-(1,1'-biphenyl)-4-yl-N1-methyl-2-oxononanediamide
• 英文别名: N-methyl-2-oxo-N'-(4-phenylphenyl)nonanediamide
• 化学式: C₂₂H₂₆N₂O₃
• 分子量: 366.46
• InChiKey: SNPDNMKRKKGKNE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  27
• 可旋转键数：
  10
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.32
• 拓扑面积：
  75.3
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  7-羟基庚酸 在 AtH₂⁽¹⁺⁾*HO^(1-) 、 carbodiimide-PS resin 、 碳酸氢钠 、 溶剂黄146 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 、 三乙胺 、 cesium fluoride 、 lithium chloride 作用下， 以 四氢呋喃 、 N,N-二甲基甲酰胺 、 乙腈 为溶剂， 生成 N9-(1,1'-biphenyl)-4-yl-N1-methyl-2-oxononanediamide
  参考文献：
  名称：

  α-Keto amides as inhibitors of histone deacetylase

  摘要：

  alpha-Keto ester and amides were found to be potent inhibitors of historic deacetylase. Nanomolar inhibitors against the isolated enzyme and sub-micromolar inhibitors of cellular proliferation were obtained. The alpha-keto amide 30 also exhibited significant anti-tumor effects in an in vivo tumor model. (C) 2003 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(03)00685-1

文献信息

• α-Keto amides as inhibitors of histone deacetylase
  作者：Carol K. Wada、Robin R. Frey、Zhiqin Ji、Michael L. Curtin、Robert B. Garland、James H. Holms、Junling Li、Lori J. Pease、Jun Guo、Keith B. Glaser、Patrick A. Marcotte、Paul L. Richardson、Shannon S. Murphy、Jennifer J. Bouska、Paul Tapang、Terrance J. Magoc、Daniel H. Albert、Steven K. Davidsen、Michael R. Michaelides

  DOI：10.1016/s0960-894x(03)00685-1

  日期：2003.10

  alpha-Keto ester and amides were found to be potent inhibitors of historic deacetylase. Nanomolar inhibitors against the isolated enzyme and sub-micromolar inhibitors of cellular proliferation were obtained. The alpha-keto amide 30 also exhibited significant anti-tumor effects in an in vivo tumor model. (C) 2003 Elsevier Ltd. All rights reserved.