2-hydroxy-6-nitro-quinoline-4-carboxylic acid ethyl ester | 104396-39-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 2-hydroxy-6-nitro-quinoline-4-carboxylic acid ethyl ester
• 英文别名: 2-Hydroxy-6-nitro-chinolin-4-carbonsaeure-aethylester；ethyl 6-nitro-2-oxo-1H-quinoline-4-carboxylate
• CAS: 104396-39-6
• 化学式: C₁₂H₁₀N₂O₅
• 分子量: 262.222
• InChiKey: FWTZNMGLEKSQRF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  101
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  2-hydroxy-6-nitro-quinoline-4-carboxylic acid ethyl ester 在 一水合肼 作用下， 以 乙醇 为溶剂， 以75%的产率得到6-nitro-2-oxo-1,2-dihydroquinoline-4-carbohydrazide
  参考文献：
  名称：

  Construction and functionalization of fused pyridine ring leading to novel compounds as potential antitubercular agents

  摘要：

  A series of fused and functionalized pyridine derivatives were designed, synthesized and tested for their potential antitubercular properties. All these novel compounds were prepared by using multistep methods involving the construction of pyridine ring as a key synthetic step. Some of these compounds were found to be interesting when tested for their antitubercular properties in vitro and one of them appeared as an attractive and potential antitubercular agent. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.05.096
• 作为产物：
  描述：

  ethyl 2-oxo-1,2-dihydroquinoline-4-carboxylate 在 硫酸 、 potassium nitrate 作用下， 生成 2-hydroxy-6-nitro-quinoline-4-carboxylic acid ethyl ester
  参考文献：
  名称：

  Mei et al., Yaoxue Xuebao/Acta pharmaceutica Sinica, 1959, vol. 7, p. 311,316

  摘要：

  DOI：

文献信息

• β-Acid as One of the Nutritive Factors. (Synthesis of β-acid)
  作者：Katashi Makino、Nobuo Hujihara

  DOI：10.1246/bcsj.19.95

  日期：1944.4
• Construction and functionalization of fused pyridine ring leading to novel compounds as potential antitubercular agents
  作者：Balakrishna Dulla、Baojie Wan、Scott G. Franzblau、Ravikumar Kapavarapu、Oliver Reiser、Javed Iqbal、Manojit Pal

  DOI：10.1016/j.bmcl.2012.05.096

  日期：2012.7

  A series of fused and functionalized pyridine derivatives were designed, synthesized and tested for their potential antitubercular properties. All these novel compounds were prepared by using multistep methods involving the construction of pyridine ring as a key synthetic step. Some of these compounds were found to be interesting when tested for their antitubercular properties in vitro and one of them appeared as an attractive and potential antitubercular agent. (C) 2012 Elsevier Ltd. All rights reserved.
• Mei et al., Yaoxue Xuebao/Acta pharmaceutica Sinica, 1959, vol. 7, p. 311,316
  作者：Mei et al.

  DOI：——

  日期：——