6-Phenyl-4-pyridin-2-yl-9-oxa-5-azatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),6,11,13,15,17-hexaen-8-one | 263873-97-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 萘并吡喃类
• 英文名称: 6-Phenyl-4-pyridin-2-yl-9-oxa-5-azatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),6,11,13,15,17-hexaen-8-one
• 英文别名: 6-phenyl-4-pyridin-2-yl-9-oxa-5-azatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),6,11,13,15,17-hexaen-8-one
• CAS: 263873-97-8
• 化学式: C₂₇H₂₀N₂O₂
• 分子量: 404.468
• InChiKey: VXIZPOQTUYYSFL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  31
• 可旋转键数：
  2
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  51.2
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  6-Phenyl-4-pyridin-2-yl-9-oxa-5-azatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),6,11,13,15,17-hexaen-8-one 在 1,2,3,4,5,6,7,8-八硫杂环辛烷 、 萘 作用下， 以49%的产率得到6-Phenyl-4-pyridin-2-yl-9-oxa-5-azatetracyclo[8.8.0.02,7.013,18]octadeca-1(10),2,4,6,11,13,15,17-octaen-8-one
  参考文献：
  名称：

  Pyridine-fused coumarins: a new class of ligands for ruthenium complexes with enhanced spectral absorption

  摘要：

  New 2,4-diaryl chromeno[3,4c]pyridin-5-ones were prepared starting from beta-ketoester, salicylacylaldehydes and 2-acetylpyridine. Some ruthenium(II) complexes using these cyclometallating ligands were also synthesized. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(99)02255-8
• 作为产物：
  描述：

  2-Benzoyl-1-(2-oxo-2-pyridin-2-ylethyl)-1,2-dihydrobenzo[f]chromen-3-one 在 ammonium acetate 作用下， 以 甲醇 、 溶剂黄146 为溶剂， 以2%的产率得到3-苯甲酰苯并[f]香豆素
  参考文献：
  名称：

  Pyridine-fused coumarins: a new class of ligands for ruthenium complexes with enhanced spectral absorption

  摘要：

  New 2,4-diaryl chromeno[3,4c]pyridin-5-ones were prepared starting from beta-ketoester, salicylacylaldehydes and 2-acetylpyridine. Some ruthenium(II) complexes using these cyclometallating ligands were also synthesized. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(99)02255-8

文献信息

• Pyridine-fused coumarins: a new class of ligands for ruthenium complexes with enhanced spectral absorption
  作者：Jean-Christophe Raboin、Marc Beley、Gilbert Kirsch

  DOI：10.1016/s0040-4039(99)02255-8

  日期：2000.2

  New 2,4-diaryl chromeno[3,4c]pyridin-5-ones were prepared starting from beta-ketoester, salicylacylaldehydes and 2-acetylpyridine. Some ruthenium(II) complexes using these cyclometallating ligands were also synthesized. (C) 2000 Elsevier Science Ltd. All rights reserved.