N-{1-[3,5-bis(trifluoromethyl)phenyl]ethyl}-N-{[2-(morpholino)-5-(trifluoromethyl)phenyl]methyl}-5-[2-(methylsulfonyl)ethoxy]pyrimidin-2-amine | 1072907-19-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 恶嗪烷类
• 英文名称: N-{1-[3,5-bis(trifluoromethyl)phenyl]ethyl}-N-{[2-(morpholino)-5-(trifluoromethyl)phenyl]methyl}-5-[2-(methylsulfonyl)ethoxy]pyrimidin-2-amine
• 英文别名: N-[1-[3,5-bis(trifluoromethyl)phenyl]ethyl]-5-(2-methylsulfonylethoxy)-N-[[2-morpholin-4-yl-5-(trifluoromethyl)phenyl]methyl]pyrimidin-2-amine
• CAS: 1072907-19-7
• 化学式: C₂₉H₂₉F₉N₄O₄S
• 分子量: 700.625
• InChiKey: JTFRFRCOURIFCF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.8
• 重原子数：
  47
• 可旋转键数：
  10
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  93.2
• 氢给体数：
  0
• 氢受体数：
  17

文献信息

• NOVEL PYRIMIDINE COMPOUND HAVING DIBENZYLAMINE STRUCTURE AND MEDICAMENT COMPRISING THE SAME
  申请人：OHGIYA Tadaaki

  公开号：US20090082352A1

  公开（公告）日：2009-03-26

  A compound represented by the following general formula (I), wherein R 1 , R 2 , R 3 , R 4 and R 5 represent hydrogen atom, a halo(lower alkyl) group, cyano group and the like, R 6 represents an alkyl group, a cycloalkyl group and the like, R 7 , R 8 , R 9 and R 10 represent hydrogen atom, a halogen atom, a lower alkyl group, a halo(lower alkyl) group and the like, R 11 and R 12 represent hydrogen atom, a lower alkyl group, a (lower cycloalkyl) (lower alkyl) group and the like, and R 13 represents hydrogen atom, a halogen atom, a lower alkoxy group and the like, which has potent inhibitory activity on cholesterol ester transfer protein (CETP).

  一个由以下通用公式（I）表示的化合物，其中R1、R2、R3、R4和R5代表氢原子、卤素（低烷基）基团、氰基团等，R6代表烷基基团、环烷基基团等，R7、R8、R9和R10代表氢原子、卤素原子、低烷基基团、卤素（低烷基）基团等，R11和R12代表氢原子、低烷基基团、（低环烷基）（低烷基）基团等，R13代表氢原子、卤素原子、低烷氧基团等，具有对胆固醇酯转移蛋白（CETP）具有强大抑制活性的化合物。
• NOVEL PYRIMIDINE COMPOUND HAVING DIBENZYLAMINE STRUCTURE, AND MEDICINE COMPRISING THE COMPOUND
  申请人：Kowa Company. Ltd.

  公开号：EP2149563A1

  公开（公告）日：2010-02-03

  A compound represented by the following general formula (I), wherein R1, R2, R3, R4 and R5 represent hydrogen atom, a halo(lower alkyl) group, cyano group and the like, R6 represents an alkyl group, a cycloalkyl group and the like, R7, R8, R9 and R10 represent hydrogen atom, a halogen atom, a lower alkyl group, a halo(lower alkyl) group and the like, R11 and R12 represent hydrogen atom, a lower alkyl group, a (lower cycloalkyl)(lower alkyl) group and the like, and R13 represents hydrogen atom, a halogen atom, a lower alkoxy group and the like, which has potent inhibitory activity on cholesterol ester transfer protein (CETP).

  由以下通式(I)代表的化合物，其中 R1、R2、R3、R4 和 R5 代表氢原子、卤代（低级烷基）基团、氰基等，R6 代表烷基、环烷基等，R7、R8、R9 和 R10 代表氢原子、卤素原子、低级烷基、卤代（低级烷基）基团等，R11 和 R12 代表氢原子、低级烷基、（低级环烷基）（低级烷基）基团等，以及 R13 代表卤代（低级环烷基）（低级烷基）基团等、R11和R12代表氢原子、低级烷基、（低级环烷基）（低级烷基）基团等，R13代表氢原子、卤素原子、低级烷氧基等，它们对胆固醇酯转移蛋白（CETP）具有强效抑制活性。
• US7659271B2
  申请人：——

  公开号：US7659271B2

  公开（公告）日：2010-02-09