7-Chloro-6-fluoro-4-oxo-1-prop-2-ynyl-1,8-naphthyridine-3-carboxylic acid | 1194098-44-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: 7-Chloro-6-fluoro-4-oxo-1-prop-2-ynyl-1,8-naphthyridine-3-carboxylic acid
• CAS: 1194098-44-6
• 化学式: C₁₂H₆ClFN₂O₃
• 分子量: 280.643
• InChiKey: ZOPUSBKJZSPECR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  70.5
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  7-Chloro-6-fluoro-4-oxo-1-prop-2-ynyl-1,8-naphthyridine-3-carboxylic acid 在 氯化亚砜 作用下， 以 二氯甲烷 为溶剂， 反应 4.0h， 生成 7-Chloro-6-fluoro-4-oxo-1-prop-2-ynyl-1,8-naphthyridine-3-carbonyl chloride
  参考文献：
  名称：

  1,8-Naphthyridine-3-carboxamide derivatives with anticancer and anti-inflammatory activity

  摘要：

  A number of 1-propargyl-1,8-naphthyridine-3-carboxamide derivatives (15-35) have been synthesized and screened for their in vitro cytotoxicity and anti-inflammatory activity. Compounds 22, 31 and 34 have shown high cytotoxicity against a number of cancer cell lines, while compound 24 showed significant anti-inflammatory activity. (C) 2009 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2009.03.015
• 作为产物：
  描述：

  Ethyl 7-chloro-6-fluoro-4-oxo-1-prop-2-ynyl-1,8-naphthyridine-3-carboxylate 在 盐酸 、 水 作用下， 生成 7-Chloro-6-fluoro-4-oxo-1-prop-2-ynyl-1,8-naphthyridine-3-carboxylic acid
  参考文献：
  名称：

  1,8-Naphthyridine-3-carboxamide derivatives with anticancer and anti-inflammatory activity

  摘要：

  A number of 1-propargyl-1,8-naphthyridine-3-carboxamide derivatives (15-35) have been synthesized and screened for their in vitro cytotoxicity and anti-inflammatory activity. Compounds 22, 31 and 34 have shown high cytotoxicity against a number of cancer cell lines, while compound 24 showed significant anti-inflammatory activity. (C) 2009 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2009.03.015