1-ethyl-6-fluoro-7-(5-methyl-2,5-diazabicyclo-[2.2.2]oct-2-yl)-1,4-dihydro-4-oxo-1,8-naphthyridine 3-carboxylic acid | 100936-55-8

• 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: 1-ethyl-6-fluoro-7-(5-methyl-2,5-diazabicyclo-[2.2.2]oct-2-yl)-1,4-dihydro-4-oxo-1,8-naphthyridine 3-carboxylic acid
• 英文别名: 1-Ethyl-6-fluoro-7-(5-methyl-2,5-diazabicyclo[2.2.2]octan-2-yl)-4-oxo-1,8-naphthyridine-3-carboxylic acid
• CAS: 100936-55-8
• 化学式: C₁₈H₂₁FN₄O₃
• 分子量: 360.388
• InChiKey: KMEFJHYKEZPYCT-UHFFFAOYSA-N

物化性质

• 沸点：
  565.9±50.0 °C(Predicted)
• 密度：
  1.374±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.9
• 重原子数：
  26
• 可旋转键数：
  3
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  77
• 氢给体数：
  1
• 氢受体数：
  8

文献信息

• Substituted naphthyridine-, quinoline- and benzoxazine- carboxylic acids as antibacterial agents and processes for their production
  申请人：WARNER-LAMBERT COMPANY

  公开号：EP0159174A2

  公开（公告）日：1985-10-23

  Compounds of the formula wherein Z is in which R is hydrogen, alkyl of one to three carbon atoms, hydroxyalkyl of two or three carbon atoms, benzyl, or p-aminobenzyl; R' is hydrogen or alkanoyl of from one to three carbon atoms; W is O, NR, S, or CH; X is CH, CF, or N; Y is hydrogen, fluoro, or amino; R, is hydrogen, alkyl having from one to six carbon atoms or a cation; R2 is alkyl having from one to four carbon atoms, vinyl, haloalkyl, hydroxyalkyl having from two to four carbon atoms or cycloalkyl having three to six carbon atoms; R3 is hydrogen or alkyl having from one to three carbon atoms; R4 is hydrogen or alkyl from one to three carbon atoms; or a pharmaceutically acceptable acid addition or base salt thereof. Also described are processes for producing the compounds and novel intermediates used in the manufacture of the antibacterial agents.

  式中的化合物 其中 Z 是 其中 R 是氢、一至三个碳原子的烷基、二或三个碳原子的羟烷基、苄基或对氨基苄基；R'是氢或一至三个碳原子的烷酰基；W 是 O、NR、S 或 CH；X 是 CH、CF 或 N；Y 是氢、氟或氨基；R, 是氢、一至六个碳原子的烷基或阳离子；R2是具有一至四个碳原子的烷基、乙烯基、卤代烷基、具有二至四个碳原子的羟烷基或具有三至六个碳原子的环烷基；R3是氢或具有一至三个碳原子的烷基；R4是氢或具有一至三个碳原子的烷基；或其药学上可接受的酸加成盐或碱式盐。此外，还描述了用于生产抗菌剂的化合物和新型中间体的生产工艺。
• EP0159174B1
  申请人：——

  公开号：EP0159174B1

  公开（公告）日：1991-10-23
• US4571396A
  申请人：——

  公开号：US4571396A

  公开（公告）日：1986-02-18