1-Chloro-4-methyl-2-(phenoxymethyl)benzene

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 1-Chloro-4-methyl-2-(phenoxymethyl)benzene
• 英文别名: 1-chloro-4-methyl-2-(phenoxymethyl)benzene
• 化学式: C₁₄H₁₃ClO
• 分子量: 232.7
• InChiKey: RBYCIROHXPVLLQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  16
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  9.2
• 氢给体数：
  0
• 氢受体数：
  1

文献信息

• Pharmaceutical composition containing a heterocyclic modulator of ATP-binding cassette transporters.
  申请人：Vertex Pharmaceuticals Incorporated

  公开号：EP2395002A1

  公开（公告）日：2011-12-14

  Pharmaceutically acceptable compositions of the present invention are useful as modulators of ATP-Binding Cassette ("ABC") transporters of fragments thereof, including Cystic Fibrosis Transmembrane Conductance Regulator ("CFTR").

  本发明的药学上可接受的组合物可用作 ATP 结合盒（"ABC"）转运体及其片段的调节剂，包括囊性纤维化跨膜传导调节器（"CFTR"）。
• Pharmaceutical composition containing a heterocyclic modulator of ATP-binding cassette transporters
  申请人：Vertex Pharmaceuticals Incorporated

  公开号：EP2774925A1

  公开（公告）日：2014-09-10

  Pharmaceutically acceptable compositions of the present invention are useful as modulators of ATP-Binding Cassette ("ABC") transporters of fragments thereof, including Cystic Fibrosis Transmembrane Conductance Regulator ("CFTR").

  本发明的药学上可接受的组合物可用作 ATP 结合盒（"ABC"）转运体及其片段的调节剂，包括囊性纤维化跨膜传导调节器（"CFTR"）。
• HETEROCYCLIC MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS
  申请人：Vertex Pharmaceuticals Incorporated

  公开号：EP3208272A1

  公开（公告）日：2017-08-23

  Compounds of the present invention, and pharmaceutically acceptable compositions thereof, are useful as modulators of ATP-Binding Cassette ("ABC") transporters or fragments thereof, including Cystic Fibrosis Transmembrane Conductance Regulator ("CFTR"). The present invention also relates to methods of treating ABC transporter mediated diseases using compounds of the present invention.

  本发明的化合物及其药学上可接受的组合物可用作 ATP 结合盒（"ABC"）转运体或其片段（包括囊性纤维化跨膜传导调节器（"CFTR"））的调节剂。本发明还涉及使用本发明化合物治疗 ABC 转运体介导的疾病的方法。
• Isoquinoline modulators of ATP-binding cassette transporters
  申请人：Vertex Pharmaceuticals Incorporated

  公开号：EP2578571B1

  公开（公告）日：2015-09-16
• ISOQUINOLINE MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS
  申请人：Vertex Pharmaceuticals Incorporated

  公开号：EP3012250B1

  公开（公告）日：2017-11-08