3-chloro-2-chlorosulfonylquinoline | 1219101-07-1

• 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: 3-chloro-2-chlorosulfonylquinoline
• 英文别名: 3-Chloroquinoline-2-sulfonyl chloride；3-chloroquinoline-2-sulfonyl chloride
• CAS: 1219101-07-1
• 化学式: C₉H₅Cl₂NO₂S
• 分子量: 262.116
• InChiKey: YFVWKOWHRRFAQS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  55.4
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  bis(3-chloroquinolin-2-yl) disulfide 在 盐酸 、 sodium hypochlorite 作用下， 以 水 为溶剂， 以97%的产率得到3-chloro-2-chlorosulfonylquinoline
  参考文献：
  名称：

  From 2,3-, 2,6-, 3,4- and 4,6-Dichloroquinolines to Isomeric Chloroquinolinesulfonyl Chlorides

  摘要：

  The action of sodium methanethiolate (in boiling DMF) on x,y-dichloroquinolines (1) (x=3 or 6, y=2 or 4) occured via chlorine ipso-substitution followed by methanethiolato-S-demthylation to yield x,y-quinolinedithiolates 2A which were: i) subjected to S-methylation, ii) oxidatively chlorinated to y,y'-bis(x-chloro-x-quinolinesulfonyl chlorides (5). Oxidative chlorination of y,y'-bis(x-chloro quinolinyl) disulfides (7) led to x-chloro-y-quinolinesulfonyl chlorides (8) accompanied by x,y-dichloroquinolines (1). Both quinolinessulfonyl chlorides 5 and 8 were efficiently converted to the corresponding quinolinesulfonamides 6 and 9.

  DOI：

  10.3987/com-09-11855

文献信息

• BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS AND USES THEREOF
  申请人：BARNES David Weninger

  公开号：US20120028969A1

  公开（公告）日：2012-02-02

  The present invention provides compounds of formula (I); or pharmaceutically acceptable salts thereof, wherein the variables are defined as herein. The present invention provides a method for manufacturing the compounds of formula (I), their therapeutic uses, combinations with other of pharmacologically active agents, and a pharmaceutical compositions.

  本发明提供了式(I)的化合物；或其药学上可接受的盐，其中变量如本文所定义。本发明提供了一种制造式(I)化合物的方法，它们的治疗用途，与其他药理活性剂的组合，以及药物组成。
• BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS
  申请人：Novartis AG

  公开号：EP2598486A1

  公开（公告）日：2013-06-05
• US8697739B2
  申请人：——

  公开号：US8697739B2

  公开（公告）日：2014-04-15
• US9789118B2
  申请人：——

  公开号：US9789118B2

  公开（公告）日：2017-10-17
• [EN] BICYCLIC ACETYL-COA CARBOXYLASE INHIBITORS<br/>[FR] INHIBITEURS D'ACÉTYL-COA-CARBOXYLASE BICYCLIQUES
  申请人：NOVARTIS AG

  公开号：WO2012013716A1

  公开（公告）日：2012-02-02

  The present invention provides compounds of formula (I); or pharmaceutically acceptable salts thereof, wherein the variables are defined as herein. The present invention provides a method for manufacturing the compounds of formula (I), their therapeutic uses, combinations with other of pharmacologically active agents, and a pharmaceutical compositions.