5-cyclo-propylmethoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyrimidine | 98050-83-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: 5-cyclo-propylmethoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyrimidine
• 英文别名: 5-Cyclopropylmethoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyrimidine；cyclopropylmethyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyrimidine-5-carboxylate
• CAS: 98050-83-0
• 化学式: C₁₇H₁₉N₃O₄
• 分子量: 329.356
• InChiKey: HCEXTVRCGWPBKN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 重原子数：
  24
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.41
• 拓扑面积：
  96.5
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  2-甲氧基氯甲酸乙酯 、 5-cyclo-propylmethoxycarbonyl-2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyrimidine 在 sodium hydride 作用下， 生成 5-O-(cyclopropylmethyl) 3-O-(2-methoxyethyl) 2,6-dimethyl-4-(2-nitrophenyl)-4H-pyrimidine-3,5-dicarboxylate
  参考文献：
  名称：

  Synthesis of novel dihydropyrimidines and tetrahydropyrimidines

  摘要：

  DOI：

  10.1021/jo00222a009

文献信息

• N-substituted 3,4-dihydropyrimidine derivatives as agents for treating
  申请人：Suntory Limited

  公开号：US04772602A1

  公开（公告）日：1988-09-20

  A N-substituted 3,4-dihydropyrimidine derivative of the formula (1): ##STR1## Wherein R.sup.1 is --(CH.sub.2).sub.n --X; X is substituted aminoethyl, substituted sulfideethyl, substituted or nonsubstituted heterocyclo-ethyl wherein the ethylene group is directly bonded to a hetero atom in the heterocyclic ring, or substituted or nonsubstituted heterocyclo-methyl wherein the methylene group is directly bonded to a carbon atom in the heterocyclic ring; n is an integer from 0 to 8; R.sup.2 is straight, branched cyclic or cyclo-straight alkyl having from one to thirteen carbon atoms, or aralkyl having from seven to thirteen carbon atoms and pharmacologically acceptable acid additional salts thereof have substantially strong and long lasting effects. Therefore the compounds are useful as agents for treating disorders of the cardiovascular system, and are useful, for example, as antihypertensive agents, circulation improvers and antianginal agents. A process for producing the above compounds economically and effectively is also disclosed.

  一种N-取代的3,4-二氢嘧啶衍生物，化学式如下（1）：其中R.sup.1为--(CH.sub.2).sub.n --X；X为取代氨基乙基、取代硫醚乙基、取代或非取代杂环乙基，其中乙烯基直接键合到杂环环中的杂原子，或取代或非取代杂环甲基，其中亚甲基直接键合到杂环环中的碳原子；n为0至8的整数；R.sup.2为直链、支链、环状或环-直链烷基，含有1至13个碳原子，或含有7至13个碳原子的芳基烷基，以及其药理学上可接受的酸附加盐具有显著强而持久的作用。因此，这些化合物可用作治疗心血管系统疾病的药物，例如用作降压药、循环改善剂和抗心绞痛药。还公开了一种经济有效地生产上述化合物的方法。
• Synthesis of 3-Substituted 3,4-Dihydropyrimidines: N-Alkoxycarbonylation with Trichloromethyl Chloroformate and Alcohols
  作者：Hidetsura Cho、Akira Mizuno、Keiyuu Shima、Masaru Ueda、Yumi Takeuchi、Mikiko Hamaguchi、Nobuaki Taniguchi

  DOI：10.3987/com-87-4417

  日期：——
• CHO, HIDETSURA;MIZUNO, AKIRA;SHIMA, KEIYU
  作者：CHO, HIDETSURA、MIZUNO, AKIRA、SHIMA, KEIYU

  DOI：——

  日期：——
• CHO, HIDETSURA;UEDA, MASARU;SHIMA, KEIYUU;MIZUNO, AKIRA;HAYASHIMATSU, MAR+, J. MED. CHEM., 32,(1989) N0, C. 2399-2406
  作者：CHO, HIDETSURA、UEDA, MASARU、SHIMA, KEIYUU、MIZUNO, AKIRA、HAYASHIMATSU, MAR+

  DOI：——

  日期：——
• N-substituted 3,4-dihydropyrimidine derivatives, process for the production thereof and composition containing same for treating disorders of cardiovascular system
  申请人：SUNTORY LIMITED

  公开号：EP0195374B1

  公开（公告）日：1992-07-29