6H-quino<2,3-b><1,5>benzodiazepine | 107607-71-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯二氮卓类
• 英文名称: 6H-quino<2,3-b><1,5>benzodiazepine
• 英文别名: 6H-quino[2,3-b][1,5]benzodiazepine；6H-quinolino[2,3-b][1,5]benzodiazepine
• CAS: 107607-71-6
• 化学式: C₁₆H₁₁N₃
• 分子量: 245.283
• InChiKey: JQOGBSKVEZFBIW-UHFFFAOYSA-N

物化性质

• 熔点：
  62 °C(Solv: acetone (67-64-1); ethyl ether (60-29-7))
• 沸点：
  477.9±24.0 °C(Predicted)
• 密度：
  1.28±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.04
• 重原子数：
  19.0
• 可旋转键数：
  0.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  37.28
• 氢给体数：
  1.0
• 氢受体数：
  3.0

反应信息

• 作为反应物：
  描述：

  6H-quino<2,3-b><1,5>benzodiazepine 在 sodium tetrahydroborate 作用下， 以 甲醇 为溶剂， 反应 2.5h， 生成 11,12-dihydro-6H-quino<2,3-b><1,5>benzodiazepine
  参考文献：
  名称：

  Bhanumathi, Nanduri; Rao, Kakulapati Rama; Sattur, Prahlad Balvantrao, Heterocycles, 1986, vol. 24, # 6, p. 1683 - 1685

  摘要：

  DOI：
• 作为产物：
  描述：

  2-氯-3-喹啉甲醛 、 邻苯二胺 在 溶剂黄146 、 potassium iodide 作用下， 反应 0.17h， 生成 6H-quino<2,3-b><1,5>benzodiazepine
  参考文献：
  名称：

  Binding and Oxidative Cleavage Studies of DNA by Mixed Ligand Co(III) and Ni(II) Complexes of Quinolo [3,2-b]Benzodiazapine and 1,10-Phenanthroline

  摘要：

  Two mixed ligand complexes of the type [M(phen)(2)(qbdp)](PF6)n.xH(2)O where M = Co(III) and Ni(II), qbdp = quinolo[3,2-b] benzodiazepine and phen = 1,10-phenanthroline, n = 3 or 2, x = 2 or 3 have been synthesized and characterized by employing analytical and spectral methods. The DNA binding property of the complexes with calf thymus- DNA has been investigated by using absorption spectra, viscosity measurements as well as thermal denaturation studies. The absorption spectral results indicate that the Co(III) and Ni(II) complexes intercalate between the base pairs of the DNA tightly with intrinsic DNA binding constant of 6.4 x 10(4) and 4.8 x 10(4) M-1 in Tris HCl buffer containing 50 mM NaCl, respectively. The large enhancement in the relative viscosity of DNA on binding to the quinolo [3,2-b] benzodiazepine supports the proposed DNA binding modes. The complexes on reaction with super coiled (SC) DNA shows nuclease activity.

  DOI：

  10.1080/15257770701426237

文献信息

• BHANUMATHI NANDURI; RAO KAKULAPATI RAMA; SATTUR PRAHLAD BALVANTRAO, HETEROCYCLES, 24,(1986) N 6, 1683-1685
  作者：BHANUMATHI NANDURI、 RAO KAKULAPATI RAMA、 SATTUR PRAHLAD BALVANTRAO

  DOI：——

  日期：——