2-(coumarin-4-yloxymethyl)-3,5-diethoxycarbonyl-6-methyl-4-(2-trifluoromethylphenyl)-1,4-dihydropyridine | 327161-80-8

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 香豆素及其衍生物
• 英文名称: 2-(coumarin-4-yloxymethyl)-3,5-diethoxycarbonyl-6-methyl-4-(2-trifluoromethylphenyl)-1,4-dihydropyridine
• 英文别名: Diethyl 2-methyl-6-[(2-oxochromen-4-yl)oxymethyl]-4-[2-(trifluoromethyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylate
• CAS: 327161-80-8
• 化学式: C₂₉H₂₆F₃NO₇
• 分子量: 557.523
• InChiKey: SNBHNURHYXJILG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  40
• 可旋转键数：
  10
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.28
• 拓扑面积：
  100
• 氢给体数：
  1
• 氢受体数：
  11

文献信息

• 1,4-DIHYDROPYRIDINE-5-CARBOXYLIC ACID ESTER DERIVATIVES AND METHOD FOR THE PREPARATION THEREOF
  申请人：Rephartox

  公开号：EP1214315B9

  公开（公告）日：2004-01-02
• US6689799B1
  申请人：——

  公开号：US6689799B1

  公开（公告）日：2004-02-10
• [EN] 1,4-DIHYDROPYRIDINE-5-CARBOXYLIC ACID ESTER DERIVATIVES AND METHOD FOR THE PREPARATION THEREOF<br/>[FR] DERIVES D'ESTER D'ACIDE 1,4-DIHYDROPYRIDINE-5-CARBOXYLIQUE ET LEUR PROCEDE DE PREPARATION
  申请人：REPHARTOX

  公开号：WO2001014370A1

  公开（公告）日：2001-03-01

  The present invention relates to ester derivatives of 1,4-dihydropyridine-5-carboxylic acid of formula (I) wherein R1, R2 and R3 may be a coumarin group. These compounds possess an anti-viral activity. Most of the anti-viral compounds known in the art are nucleoside-derivatives. Various viruses become resistent against these. Because the compounds according to the invention are not nucleoside-derivatives, they form a suitable alternative. The invention also relates to a method of preparing the anti-viral substances according to the invention.