2-[(4-phenylmethoxyphenyl)methylidene]cyclopentan-1-one | 184592-37-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 2-[(4-phenylmethoxyphenyl)methylidene]cyclopentan-1-one
• CAS: 184592-37-8
• 化学式: C₁₉H₁₈O₂
• 分子量: 278.351
• InChiKey: UIDFTNNTLUXLDA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  21.0
• 可旋转键数：
  4.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  26.3
• 氢给体数：
  0.0
• 氢受体数：
  2.0

反应信息

• 作为反应物：
  描述：

  2-[(4-phenylmethoxyphenyl)methylidene]cyclopentan-1-one 在 palladium dihydroxide 、 镍 4-二甲氨基吡啶 、 sodium tetrahydroborate 、 氢气 、 三乙胺 、 三氟乙酸 作用下， 以 二氯甲烷 、 乙酸乙酯 为溶剂， 生成 (+/-)-anti-methyl 2-{[2,6-dihydroxy-4-({[2-(4-hydroxybenzyl)cyclopentyl]oxy}carbonyl)phenyl]carbonyl}-3-hydroxybenzoate
  参考文献：
  名称：

  Potent and selective PKC inhibitory 5-membered ring analogs of balanol with replacement of the carboxamide moiety

  摘要：

  Balanol ((-)-1) is a potent protein kinase inhibitory natural product isolated from the fungus Verticillium balanoides. The lack of cellular activity and protein kinase C selectivity in balanol has prompted a search for analogs that incorporate these properties, This paper describes the synthesis and biological activity of such compounds with substitution similar to balanol, but with a single atom bridge in place of the carboxamide moiety. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/0960-894x(96)00311-3
• 作为产物：
  描述：

  4-苄氧基苯甲醛 、 环戊酮 在 氢氧化钾 作用下， 以 水 为溶剂， 以61%的产率得到2-[(4-phenylmethoxyphenyl)methylidene]cyclopentan-1-one
  参考文献：
  名称：

  Potent and selective PKC inhibitory 5-membered ring analogs of balanol with replacement of the carboxamide moiety

  摘要：

  Balanol ((-)-1) is a potent protein kinase inhibitory natural product isolated from the fungus Verticillium balanoides. The lack of cellular activity and protein kinase C selectivity in balanol has prompted a search for analogs that incorporate these properties, This paper describes the synthesis and biological activity of such compounds with substitution similar to balanol, but with a single atom bridge in place of the carboxamide moiety. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/0960-894x(96)00311-3