4-[(2Z,4E)-3-methoxycarbonyl-5-(3-methoxyphenyl)-4-[(2-methylpyridin-4-yl)carbamoyl]penta-2,4-dien-2-yl]benzoic acid

• 分子结构分类: 有机化合物 - 木脂素、新木脂素和相关化合物
• 英文名称: 4-[(2Z,4E)-3-methoxycarbonyl-5-(3-methoxyphenyl)-4-[(2-methylpyridin-4-yl)carbamoyl]penta-2,4-dien-2-yl]benzoic acid
• 化学式: C₂₈H₂₆N₂O₆
• 分子量: 486.5
• InChiKey: PCOAVAUOBBPAMH-FCIGTWOJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  36
• 可旋转键数：
  9
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  115
• 氢给体数：
  2
• 氢受体数：
  7

文献信息

• Novel butadiene derivatives, process for preparation of the same and intermediates for the synthesis thereof
  申请人：——

  公开号：US20040180938A1

  公开（公告）日：2004-09-16

  A butadiene derivative having an excellent inhibitory activity on the PAI-1, which is represented by the general formula [I]: 1 wherein R 1 is a hydrogen atom or a lower alkyl group, R 2 is a lower alkyl group, R 3 is a lower alkoxy group, R 4 is a hydrogen atom or a lower alkyl group, R 5 is a lower alkyl group, or a pharmaceutically acceptable salt thereof, a process a process for preparing the same and an intermediate thereof.

  一种丁二烯衍生物，具有卓越的对PAI-1的抑制活性，其通式表示为[I]：其中R1为氢原子或较低的烷基，R2为较低的烷基，R3为较低的烷氧基，R4为氢原子或较低的烷基，R5为较低的烷基，或其药学上可接受的盐，以及其制备方法和中间体。
• NOVEL BUTADIENE DERIVATIVES, PROCESS FOR PREPARATION OF THE SAME AND INTERMEDIATES FOR THE SYNTHESIS THEREOF
  申请人：Tanabe Seiyaku Co., Ltd.

  公开号：EP1403252A1

  公开（公告）日：2004-03-31

  A butadiene derivative having an excellent inhibitory activity on the PAI-1, which is represented by the general formula [I]: wherein R1 is a hydrogen atom or a lower alkyl group, R2 is a lower alkyl group, R3 is a lower alkoxy group, R4 is a hydrogen atom or a lower alkyl group, R5 is a lower alkyl group, or a pharmaceutically acceptable salt thereof, a process a process for preparing the same and an intermediate thereof.

  一种对PAI-1具有优异抑制活性的丁二烯衍生物，由通式[I]表示： 其中 R1 为氢原子或低级烷基，R2 为低级烷基，R3 为低级烷氧基，R4 为氢原子或低级烷基，R5 为低级烷基，或其药学上可接受的盐、制备方法及其中间体。