tert-butyl N-[(1R)-3-[[3,5-bis(trifluoromethyl)phenyl]methylcarbamoyl]-3-methylsulfonylcyclopentyl]carbamate | 693246-48-9

• 英文名称: tert-butyl N-[(1R)-3-[[3,5-bis(trifluoromethyl)phenyl]methylcarbamoyl]-3-methylsulfonylcyclopentyl]carbamate
• CAS: 693246-48-9
• 化学式: C₂₁H₂₆F₆N₂O₅S
• 分子量: 532.504
• InChiKey: SXQCKMYGDZSFQL-NYRJJRHWSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  35
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.62
• 拓扑面积：
  110
• 氢给体数：
  2
• 氢受体数：
  11

反应信息

• 作为产物：
  描述：

  tert-butyl N-[(1R)-3-[[3,5-bis(trifluoromethyl)phenyl]methylcarbamoyl]-3-methylsulfanylcyclopentyl]carbamate 在 oxone 作用下， 以 水 、 异丙醇 为溶剂， 反应 2.0h， 以97%的产率得到tert-butyl N-[(1R)-3-[[3,5-bis(trifluoromethyl)phenyl]methylcarbamoyl]-3-methylsulfonylcyclopentyl]carbamate
  参考文献：
  名称：

  [EN] TETRAHYDROPYRANYL CYCLOPENTYL TETRAHY-DROPYRIDOPYRIDINE MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY
  [FR] TETRAHYDROPYRANYL CYCLOPENTYL TETRAHY-DROPYRIDOPYRIDINE MODULANT L'ACTIVITE DES RECEPTEURS DE LA CHIMIOKINE

  摘要：

  公开号：

  WO2005120505A3

文献信息

• Tetrahydropyranyl Cyclopentyl Tetrahydropyridopyridine Modulators of Chemokine Receptor Activity
  申请人：Yang Lihu

  公开号：US20080021061A1

  公开（公告）日：2008-01-24

  Compounds of Formula I: (wherein n, R 1 , R 3 , R 4 , R 5 , R 6 , R 7 , R 8 , R 9 , R 10 , R 15 , R 16 , Y and Z are as defined herein) which are modulators of chemokine receptor activity and are useful in the prevention or treatment of certain inflammatory and immunoregulatory disorders and diseases, allergic diseases, atopic conditions including allergic rhinitis, dermatitis, conjunctivitis, and asthma, as well as autoimmune pathologies such as rheumatoid arthritis and atherosclerosis. The invention is also directed to pharmaceutical compositions comprising these compounds and the use of these compounds and compositions in the prevention or treatment of such diseases in which chemokine receptors are involved.
• US7390803B2
  申请人：——

  公开号：US7390803B2

  公开（公告）日：2008-06-24
• US7557124B2
  申请人：——

  公开号：US7557124B2

  公开（公告）日：2009-07-07