3-[4-(2-methoxyphenyl)piperazinylethyl]-6-methyl-5-phenylthieno[2,3-d]pyrimidine-2,4dione

• 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-[4-(2-methoxyphenyl)piperazinylethyl]-6-methyl-5-phenylthieno[2,3-d]pyrimidine-2,4dione
• 英文别名: 3-{2-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-ethyl}-6-methyl-5-phenyl-1H-thieno[2,3-d]pyrimidine-2,4-dione；3-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-6-methyl-5-phenyl-1H-thieno[2,3-d]pyrimidine-2,4-dione
• 化学式: C₂₆H₂₈N₄O₃S
• 分子量: 476.599
• InChiKey: MTWNRUIQFUUTJU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  34
• 可旋转键数：
  6
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  93.4
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  N-(3-carboethoxy-5-methyl-4-phenylthien-2-yl)-N'-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-urea 在 potassium tert-butylate 作用下， 以 乙醇 为溶剂， 生成 3-[4-(2-methoxyphenyl)piperazinylethyl]-6-methyl-5-phenylthieno[2,3-d]pyrimidine-2,4dione
  参考文献：
  名称：

  Two Novel and Potent 3-[(o-Methoxyphenyl)piperazinylethyl]-5-phenylthieno[2,3-d]pyrimidine-2,4-diones Selective for the α1D Receptor

  摘要：

  ,The synthesis and in vitro characterization of A-119637 and A-123189, two novel, selective and potent alpha (1D) antagonists, are described. (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00159-7

文献信息

• PIPERAZYNIL PYRIMIDINE DIONE COMPOUNDS SELECTIVE FOR ADRENOCEPTORS
  申请人：ABBOTT LABORATORIES

  公开号：EP1095044A1

  公开（公告）日：2001-05-02
• US6153614A
  申请人：——

  公开号：US6153614A

  公开（公告）日：2000-11-28
• US6166019A
  申请人：——

  公开号：US6166019A

  公开（公告）日：2000-12-26
• [EN] PIPERAZYNIL PYRIMIDINE DIONE COMPOUNDS SELECTIVE FOR ADRENOCEPTORS<br/>[FR] COMPOSES A BASE DE PIPERAZINYLE PYRIMIDINE-DIONE, SELECTIFS DES RECEPTEURS ADRENERGIQUES
  申请人：ABBOTT LAB

  公开号：WO2000004027A1

  公开（公告）日：2000-01-27

  Compounds of Formula (I) and their pharmaceutically acceptable salts, esters and prodrugs thereof are selective alpha-1D adrenoceptor antagonists and may be useful for treating disease states wherein R2 is (a).
• Two Novel and Potent 3-[(o-Methoxyphenyl)piperazinylethyl]-5-phenylthieno[2,3-d]pyrimidine-2,4-diones Selective for the α1D Receptor
  作者：William A Carroll、Kevin B Sippy、Timothy A Esbenshade、Steven A Buckner、Arthur A Hancock、Michael D Meyer

  DOI：10.1016/s0960-894x(01)00159-7

  日期：2001.5

  ,The synthesis and in vitro characterization of A-119637 and A-123189, two novel, selective and potent alpha (1D) antagonists, are described. (C) 2001 Elsevier Science Ltd. All rights reserved.