4-{3-[4-(1-chloroethyl)phenylthio]-5-fluorophenyl}-4-methoxytetrahydropyran | 153581-62-5

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 4-{3-[4-(1-chloroethyl)phenylthio]-5-fluorophenyl}-4-methoxytetrahydropyran
• 英文别名: 4-[3-[4-(1-chloroethyl)phenyl]sulfanyl-5-fluorophenyl]-4-methoxyoxane
• CAS: 153581-62-5
• 化学式: C₂₀H₂₂ClFO₂S
• 分子量: 380.911
• InChiKey: OECPULVAIQDPCW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  25
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  43.8
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  4-{3-[4-(1-chloroethyl)phenylthio]-5-fluorophenyl}-4-methoxytetrahydropyran 以74%的产率得到tetrahydropyran-4-one O-{4-[5-fluoro-3-(4-methoxytetrahydropyran-4-yl)phenylthio]-α-methylbenzyl}oxime
  参考文献：
  名称：

  Oxime derivatives

  摘要：

  该发明涉及式I的肟衍生物##STR1##其中R.sup.4是氢，(1-4C)烷基，卤代-(2-4C)烷基，羟基-(2-4C)烷基，氰基-(1-4C)烷基，苯基或苯基-(1-4C)烷基；R.sup.5是氢，(1-4C)烷基，卤代-(2-4C)烷基，羟基-(2-4C)烷基，氰基-(1-4C)烷基，苯基或苯基-(1-4C)烷基，或从吡啶基，嘧啶基，吡嗪基，吡啶并嗪基，呋喃基，噻吩基，噁唑基和噻唑基中选择的杂芳基；A.sup.4是(1-4C)烷基；Ar.sup.1是苯基，吡啶二基或嘧啶二基；A.sup.1是直接连接到X.sup.1或A.sup.1是(1-4C)烷基；X.sup.1是氧，硫，亚硫酰基或磺酰基；Ar.sup.2是苯基，吡啶二基，嘧啶二基，噻吩二基，呋喃二基或噻唑二基；R.sup.1是氢，(1-4C)烷基，(3-C)烯基或(3-4C)炔基；而R.sup.2和R.sup.3一起形成式--A.sup.2--X.sup.2--A.sup.3--的基团，其中每个A.sup.2和A.sup.3独立地是(1-3C)烷基，而X.sup.2是氧，硫，亚硫酰基，磺酰基或亚胺；或其药学上可接受的盐；其制备方法；含有它们的药物组合物以及它们作为5-脂氧合酶抑制剂的用途。

  公开号：

  US05376680A1

文献信息

• Hydroxylamine derivatives
  申请人：Zeneca Ltd.

  公开号：US05334614A1

  公开（公告）日：1994-08-02

  The invention concerns hydroxylamine derivatives of the formula I ##STR1## wherein R.sup.4 is hydrogen, carbamoyl, (1-4C)alkyl, cyclopentyl, cyclohexyl, tetrahydrofuran-3-yl, tetrahydropyran-4-yl, piperidin-4-yl, N-(1-4C)alkylpiperidin-4-yl, (2-5C)alkanoyl, (1-4C)alkylsulphonyl, N-(1-4C)alkylcarbamoyl, N,N-di-(1-4C)alkylcarbamoyl, phenyl, phenyl-(1-4C)alkyl, di-phenyl-(1-4C)alkyl, benzoyl, phenylsulphonyl or a heteroarylmethyl group; R.sup.5 is hydrogen, (1-4C)alkyl, (3-4C)alkenyl, (3-4C)alkynyl, cyano-(1-4C)alkyl, phenyl or phenyl-(1-4C)alkyl; A.sup.4 is (1-4C)alkylene; Ar.sup.1 is phenylene, pyridinediyl or pyrimidinediyl; A.sup.1 is a direct link to X.sup.1, or A.sup.1 is (1-4C)alkylene; X.sup.1 is oxy, thio, sulphinyl or sulphonyl; Ar.sup.2 is phenylene, pyridinediyl, pyrimidinediyl, thiophenediyl, furandiyl or thiazolediyl; R.sup.1 is hydrogen, (1-4C)alkyl, (3-4C)alkenyl or (3-4C)alkynyl; and R.sup.2 and R.sup.3 together form a group of the formula -A.sup.2 -X.sup.2 -A.sup.3 -wherein each of A.sup.2 and A.sup.3 is independently (1-3C)alkylene and X.sup.2 is oxy, thio, sulphinyl, sulphonyl or imino; or a pharmaceutically-acceptable salt thereof; processes for their manufacture; pharmaceutical compositions containing them and their use as 5-lipoxygenase inhibitors.

  该发明涉及以下化学式I的羟胺衍生物##STR1##其中R.sup.4是氢、氨基甲酰、(1-4C)烷基、环戊基、环己基、四氢呋喃-3-基、四氢吡喃-4-基、哌啶-4-基、N-(1-4C)烷基哌啶-4-基、(2-5C)烷酰基、(1-4C)烷基磺酰基、N-(1-4C)烷基氨基甲酰基、N,N-二-(1-4C)烷基氨基甲酰基、苯基、苯基-(1-4C)烷基、二苯基-(1-4C)烷基、苯甲酰基、苯基磺酰基或杂环芳基甲基；R.sup.5是氢、(1-4C)烷基、(3-4C)烯基、(3-4C)炔基、氰基-(1-4C)烷基、苯基或苯基-(1-4C)烷基；A.sup.4是(1-4C)烷基；Ar.sup.1是苯撑基、吡啶二基或嘧啶二基；A.sup.1是直链到X.sup.1的连接，或A.sup.1是(1-4C)烷基；X.sup.1是氧、硫、亚硫酰基或磺酰基；Ar.sup.2是苯撑基、吡啶二基、嘧啶二基、噻吩二基、呋喃二基或噻唑二基；R.sup.1是氢、(1-4C)烷基、(3-4C)烯基或(3-4C)炔基；而R.sup.2和R.sup.3共同形成一个具有以下结构的基团-A.sup.2-X.sup.2-A.sup.3-其中A.sup.2和A.sup.3中的每一个独立地是(1-3C)烷基，X.sup.2是氧、硫、亚硫酰基、磺酰基或亚胺；或其药学上可接受的盐；其制备方法；含有它们的药物组合物以及它们作为5-脂氧合酶抑制剂的用途。
• US5376680A
  申请人：——

  公开号：US5376680A

  公开（公告）日：1994-12-27
• US5334614A
  申请人：——

  公开号：US5334614A

  公开（公告）日：1994-08-02
• US5457125A
  申请人：——

  公开号：US5457125A

  公开（公告）日：1995-10-10
• Oxime derivatives
  申请人：Zeneca Limited

  公开号：US05376680A1

  公开（公告）日：1994-12-27

  The invention concerns oxime derivatives of the formula I ##STR1## wherein R.sup.4 is hydrogen, (1-4C)alkyl, halogeno-(2-4C)alkyl, hydroxy-(2-4C)alkyl, cyano-(1-4C)alkyl, phenyl or phenyl-(1-4C)alkyl; R.sup.5 is hydrogen, (1-4C)alkyl, halogeno-(2-4C)alkyl, hydroxy-(2-4C)alkyl, cyano-(1-4C)alkyl, phenyl or phenyl-(1-4C)alkyl, or a heteroaryl moiety selected from pyridyl, pyrimidinyl, pyrazinyl, pyridazinyl, furyl, thienyl, oxazolyl and thiazolyl; A.sup.4 is (1-4C)alkylene; Ar.sup.1 is phenylene, pyridinediyl or pyrimidinediyl; A.sup.1 is a direct link to X.sup.1 or A.sup.1 is (1-4C)alkylene; X.sup.1 is oxy, thio, sulphinyl or sulphonyl; Ar.sup.2 is phenylene, pyridinediyl, pyrimidinediyl, thiophenediyl, furandiyl or thiazolediyl; R.sup.1 is hydrogen, (1-4C)alkyl, (3-C)alkenyl or (3-4C)alkynyl; and R.sup.2 and R.sup.3 together form a group of the formula --A.sup.2 --X.sup.2 --A.sup.3 -- wherein each of A.sup.2 and A.sup.3 is independently (1-3C)alkylene and X.sup.2 is oxy, thio, sulphinyl, sulphonyl or imino; or a pharmaceutically-acceptable salt thereof; processes for their manufacture; pharmaceutical compositions containing them and their use as 5-lipoxygenase inhibitors.

  该发明涉及式I的肟衍生物##STR1##其中R.sup.4是氢，(1-4C)烷基，卤代-(2-4C)烷基，羟基-(2-4C)烷基，氰基-(1-4C)烷基，苯基或苯基-(1-4C)烷基；R.sup.5是氢，(1-4C)烷基，卤代-(2-4C)烷基，羟基-(2-4C)烷基，氰基-(1-4C)烷基，苯基或苯基-(1-4C)烷基，或从吡啶基，嘧啶基，吡嗪基，吡啶并嗪基，呋喃基，噻吩基，噁唑基和噻唑基中选择的杂芳基；A.sup.4是(1-4C)烷基；Ar.sup.1是苯基，吡啶二基或嘧啶二基；A.sup.1是直接连接到X.sup.1或A.sup.1是(1-4C)烷基；X.sup.1是氧，硫，亚硫酰基或磺酰基；Ar.sup.2是苯基，吡啶二基，嘧啶二基，噻吩二基，呋喃二基或噻唑二基；R.sup.1是氢，(1-4C)烷基，(3-C)烯基或(3-4C)炔基；而R.sup.2和R.sup.3一起形成式--A.sup.2--X.sup.2--A.sup.3--的基团，其中每个A.sup.2和A.sup.3独立地是(1-3C)烷基，而X.sup.2是氧，硫，亚硫酰基，磺酰基或亚胺；或其药学上可接受的盐；其制备方法；含有它们的药物组合物以及它们作为5-脂氧合酶抑制剂的用途。