3-<2-<4-(2-methoxyphenyl)piperazin-1-yl>ethyl>thieno<3,4-d>pyrimidine-2,4-dione | 110164-06-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 英文名称: 3-<2-<4-(2-methoxyphenyl)piperazin-1-yl>ethyl>thieno<3,4-d>pyrimidine-2,4-dione
• 英文别名: 3-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]thieno[3,4-d]pyrimidine-2,4-dione；3-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1H-thieno[3,4-d]pyrimidine-2,4-dione
• CAS: 110164-06-2
• 化学式: C₁₉H₂₂N₄O₃S
• 分子量: 386.475
• InChiKey: CLPCMOQAMAWWDA-UHFFFAOYSA-N

物化性质

• 熔点：
  273-275 °C
• 密度：
  1.304±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  27
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.37
• 拓扑面积：
  93.4
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  3-<2-<4-(2-methoxyphenyl)piperazin-1-yl>ethyl>thieno<3,4-d>pyrimidine-2,4-dione 以56%的产率得到
  参考文献：
  名称：

  PRESS, JEFFREY B.;RUSSELL, RONALD K.

  摘要：

  DOI：
• 作为产物：
  描述：

  3-氨基噻吩-4-羧酸甲酯盐酸盐 在 sodium hydroxide 、 三甲基铝 作用下， 以 二氯甲烷 、 甲苯 为溶剂， 反应 2.0h， 生成 3-<2-<4-(2-methoxyphenyl)piperazin-1-yl>ethyl>thieno<3,4-d>pyrimidine-2,4-dione
  参考文献：
  名称：

  Russell, Roland K.; Rampulla, Richard A.; Nievelt, Caroline E. van, Journal of Heterocyclic Chemistry, 1990, vol. 27, # 6, p. 1761 - 1770

  摘要：

  DOI：

文献信息

• Thienopyrimidine-2,4-dione derivatives and intermediates thereof
  申请人：Ortho Pharmaceutical Corporation

  公开号：US04670560A1

  公开（公告）日：1987-06-02

  The synthesis of thienopyrimidine-2,4-dione derivatives and their urea intermediates is described. The novel urea intermediates and thienopyrimidine-2,4-dione derivatives are generally vasodilating agents and anti-hypertensive agents. The compounds are useful as cardiovascular agents.

  描述了噻吩嘧啶-2,4-二酮衍生物及其脲中间体的合成。这些新颖的脲中间体和噻吩嘧啶-2,4-二酮衍生物通常是血管扩张剂和降压药。这些化合物可作为心血管药物。
• Ring-fused thienopyrimidinedione derivatives
  申请人：Ortho Pharmaceutical Corporation

  公开号：US04939137A1

  公开（公告）日：1990-07-03

  The synthesis of ring-fused thienopyrimidinedione derivatives is described. The novel ring-fused thienopyrimidinedione derivatives are generally vasodilating agents and antihypertensive agents and as such are useful as cardiovascular agents.

  本文描述了环融合噻吩嘧啶二酮衍生物的合成。这些新型的环融合噻吩嘧啶二酮衍生物通常是血管扩张剂和降压药物，因此可用作心血管药物。
• N-(substituted thienyl)-N'-(substituted piperazinyl)-ureas
  申请人：Ortho Pharmaceutical Corporation

  公开号：US04707550A1

  公开（公告）日：1987-11-17

  The synthesis of thienopyrimidine-2,4-dione derivatives and their urea intermediates is described. The novel urea intermediates and thienopyrimidine-2,4-dione derivatives are general vasodilating agents and anti-hypertensive agents. The compounds are useful as cardiovascular agents.

  本文介绍了噻唑嘧啶-2,4-二酮衍生物及其尿素中间体的合成方法。新型尿素中间体和噻唑嘧啶-2,4-二酮衍生物是通用的血管扩张剂和降压剂。这些化合物可用作心血管药物。
• Investigations into a mild Diels-Alder approach to 6-substituted quinazoline-2,4-dione derivatives
  作者：James J. McNally、Jeffery B. Press

  DOI：10.1021/jo00001a046

  日期：1991.1

  Furo[3,4-d]pyrimidine-2,4-dione (2) has been reacted with a number of dienophiles to give the Diels-Alder adducts such as 3 and 4 under very mild reaction conditions. Methyl acrylate gives only two regioisomeric endo products which have been isolated and characterized. Other dienophiles give mixtures of endo and exo products as well as of regioisomers. The product ratios were determined by high field H-1 NMR analysis. These adducts are dehydrated by treatment with acid to form some novel quinazoline-2,4-dione derivatives.
• PRESS, JEFFREY B.;RUSSELL, RONALD K.
  作者：PRESS, JEFFREY B.、RUSSELL, RONALD K.

  DOI：——

  日期：——