2-[4-(2-Adamantylcarbamoyl)-5-(cyclohexylmethoxy)pyrazol-1-yl]ethyl methanesulfonate | 937746-85-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-[4-(2-Adamantylcarbamoyl)-5-(cyclohexylmethoxy)pyrazol-1-yl]ethyl methanesulfonate
• CAS: 937746-85-5
• 化学式: C₂₄H₃₇N₃O₅S
• 分子量: 479.641
• InChiKey: POBKAERQVNOHCC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  33
• 可旋转键数：
  9
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  108
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  2-[4-(2-Adamantylcarbamoyl)-5-(cyclohexylmethoxy)pyrazol-1-yl]ethyl methanesulfonate 、 氰化钾 以 二甲基亚砜 为溶剂， 生成 N-(2-adamantyl)-1-(2-cyanoethyl)-5-(cyclohexylmethoxy)pyrazole-4-carboxamide
  参考文献：
  名称：

  HETEROCYCLIC COMPOUND HAVING INHIBITORY ACTIVITY ON 11-B-HYDROXYSTEROID DEHYDROGENASE TYPE I

  摘要：

  公开号：

  EP1953145B1
• 作为产物：
  描述：

  N-(2-adamantyl)-5-(cyclohexylmethoxy)-1-(2-hydroxyethyl)pyrazole-4-carboxamide 、 甲基磺酰氯 生成 2-[4-(2-Adamantylcarbamoyl)-5-(cyclohexylmethoxy)pyrazol-1-yl]ethyl methanesulfonate
  参考文献：
  名称：

  HETEROCYCLIC COMPOUND HAVING INHIBITORY ACTIVITY ON 11-B-HYDROXYSTEROID DEHYDROGENASE TYPE I

  摘要：

  公开号：

  EP1953145B1

文献信息

• HETEROCYCLIC COMPOUNDS HAVING TYPE I 11beta HYDROXYSTEROID DEHYDROGENASE INHIBITORY ACTIVITY
  申请人：Kurose Noriyuki

  公开号：US20090170832A1

  公开（公告）日：2009-07-02

  Disclosed is a compound useful as a type I 11βhydroxysteroid dehydrogenase inhibitor. A compound represented by the formula: a pharmaceutically acceptable salt or solvate thereof, wherein R 1 is optionally substituted alkyl or the like, one of R 2 and R 4 is a group of formula: —Y—R 5 , wherein Y is —O— or the like, R 5 is substituted alkyl (the substituent is optionally substituted cycloalkyl or the like), optionally substituted branched alkyl or the like, the other of R 2 and R 4 is hydrogen or optionally substituted alkyl, R 3 is a group of formula: —C(═O)-Z-R 6 , wherein Z is —NR 7 — or —NR 7 —W—, R 6 is optionally substituted cycloalkyl or the like, R 7 is hydrogen or optionally substituted alkyl, W is optionally substituted alkylene, X is ═N— or the like, with the proviso that compounds wherein R 2 is 2-(morphorino)ethoxy, R 3 is N-(1-adamantyl)carbamoyl and R 1 is benzyl are excluded.
• US8324265B2
  申请人：——

  公开号：US8324265B2

  公开（公告）日：2012-12-04
• HETEROCYCLIC COMPOUND HAVING INHIBITORY ACTIVITY ON 11-B-HYDROXYSTEROID DEHYDROGENASE TYPE I
  申请人：Shionogi & Co., Ltd.

  公开号：EP1953145B1

  公开（公告）日：2015-11-04