S-propyl 4-({6-[5-(methylsulfonyl)-2,3-dihydro-1H-indol-1-yl]pyrimidin-4-yl}oxy)piperidine-1-carbothioate | 1240301-18-1

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: S-propyl 4-({6-[5-(methylsulfonyl)-2,3-dihydro-1H-indol-1-yl]pyrimidin-4-yl}oxy)piperidine-1-carbothioate
• 英文别名: S-propyl 4-[6-(5-methylsulfonyl-2,3-dihydroindol-1-yl)pyrimidin-4-yl]oxypiperidine-1-carbothioate
• CAS: 1240301-18-1
• 化学式: C₂₂H₂₈N₄O₄S₂
• 分子量: 476.621
• InChiKey: PTCWKLLQYLZCFX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  32
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  126
• 氢给体数：
  0
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  tert-butyl 4-({6-[5-(methylsulfonyl)-2,3-dihydro-1H-indol-1-yl]pyrimidin-4-yl}oxy)piperidine-1-carboxylate 在 盐酸 、 三乙胺 作用下， 以 四氢呋喃 、 甲醇 、 乙酸乙酯 为溶剂， 反应 32.0h， 生成 S-propyl 4-({6-[5-(methylsulfonyl)-2,3-dihydro-1H-indol-1-yl]pyrimidin-4-yl}oxy)piperidine-1-carbothioate
  参考文献：
  名称：

  EP2399914

  摘要：

  公开号：

文献信息

• FUSED HETEROCYCLIC RING COMPOUND
  申请人：Rikimaru Kentaro

  公开号：US20120028962A1

  公开（公告）日：2012-02-02

  A compound represented by the following formula or a salt thereof, which has an GPR119 agonist action, is useful for the prophylaxis or treatment of diabetes, obesity and the like, and shows superior efficacy: wherein P: substituted 6-membered aromatic ring, Q: (substituted) 6-membered aromatic ring, CR 4a R 4b , NR 4c , O, S, SO or SO 2 R 4a-4c : H etc.}, L 1 : (substituted) C 1-5 alkylene, L 2 : a bond or (substituted) C 1-3 alkylene, L 3-4 : (substituted) C 1-3 alkylene, R 1 : H, X, CN, (substituted) hydrocarbon, (substituted) heterocycle or (substituted) OH, or (substituted) 4- to 8-membered (heterocyclic) ring together with A 1 , R 2 : H, CN, (substituted) hydrocarbon, and R 3a : —COSR A1 , (substituted) 5- or 6-membered aromatic ring R A1 : (substituted) hydrocarbon or (substituted) heterocycle}.
• US8410089B2
  申请人：——

  公开号：US8410089B2

  公开（公告）日：2013-04-02
• EP2399914
  申请人：——

  公开号：——

  公开（公告）日：——