2-hydroxymethyl-1,4-Dithiepan-6-one

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 2-hydroxymethyl-1,4-Dithiepan-6-one
• 英文别名: 2-(Hydroxymethyl)-1,4-dithiepan-6-one
• 化学式: C₆H₁₀O₂S₂
• 分子量: 178.276
• InChiKey: ZDQSVOXEUZAACB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.6
• 重原子数：
  10
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  87.9
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  hydroxymethylethanedithiol 、 1,1-二氯丙酮 在 sodium hydroxide 作用下， 以 甲醇 、 乙醇 、 sodium ethanolate 为溶剂， 以37%的产率得到2-hydroxymethyl-1,4-Dithiepan-6-one
  参考文献：
  名称：

  Dithiepino[6,5-b]pyridines, and related compositions and methods

  摘要：

  这项发明提供了以下结构的新型二噻吩并[6,5-b]吡啶化合物。这些化合物可作为钙通道拮抗剂，具有心血管、抗哮喘和抗支气管收缩活性。因此，这项发明还提供了用于预防和治疗过敏、过敏、哮喘、支气管痉挛、经前痛经、食管痉挛、青光眼、早产、泌尿道疾病、胃肠道动力障碍和心血管疾病等疾病的药物组合物以及方法。

  公开号：

  US06291454B1

文献信息

• Dithiepino [6,5-b]pyridines, and related compositions and methods
  申请人：——

  公开号：US20020026051A1

  公开（公告）日：2002-02-28

  This invention provides novel dithiepino[6,5-b]pyridines of the following formulae. 1 These compounds are useful as calcium channel antagonists with cardiovascular, antiasthmatic and antibronchoconstriction activity. Thus, this invention also provides pharmaceutical compositions, as well as methods, for preventing and treating disorders such as hypersensitivity, allergy, asthma, bronchospasm, dysmenorrhea, esophageal spasm, glaucoma, premature labor, urinary tract disorders, gastrointestinal motility disorders and cardiovascular disorders.

  本发明提供了以下公式的新型二噻吩[6,5-b]吡啶化合物。1这些化合物可用作具有心血管、抗哮喘和抗支气管痉挛活性的钙通道拮抗剂。因此，本发明还提供了用于预防和治疗过敏、过敏、哮喘、支气管痉挛、痛经、食管痉挛、青光眼、早产、泌尿道疾病、胃肠动力障碍和心血管疾病等疾病的药物组合物以及方法。
• Dithiepino[6,5-b]pyridines, and related compositions and methods
  申请人：——

  公开号：US20020032332A1

  公开（公告）日：2002-03-14

  This invention provides novel dithiepino[6,5-b]pyridines of the following formulae. 1 These compounds are useful as calcium channel antagonists with cardiovascular, antiasthmatic and antibronchoconstriction activity. Thus, this invention also provides pharmaceutical compositions, as well as methods, for preventing and treating disorders such as hypersensitivity, allergy, asthma, bronchospasm, dysmenorrhea, esophageal spasm, glaucoma, premature labor, urinary tract disorders, gastrointestinal motility disorders and cardiovascular disorders.

  这项发明提供了以下式子的新型二硫杂二环[6,5-b]吡啶化合物。1这些化合物可作为钙通道拮抗剂，具有心血管、抗哮喘和抗支气管收缩活性。因此，这项发明还提供了预防和治疗过敏、过敏、哮喘、支气管痉挛、痛经、食管痉挛、青光眼、早产、泌尿道疾病、胃肠动力障碍和心血管疾病等疾病的药物组合物和方法。
• DITHIEPINO 6,5-b]PYRIDINES, AND RELATED COMPOSITIONS AND METHODS
  申请人：Ortho-McNeil Pharmaceutical, Inc.

  公开号：EP1192163A1

  公开（公告）日：2002-04-03
• US6291454B1
  申请人：——

  公开号：US6291454B1

  公开（公告）日：2001-09-18
• [EN] DITHIEPINO[6,5-b]PYRIDINES, AND RELATED COMPOSITIONS AND METHODS<br/>[FR] DITHIEPINO[6,5-b]PYRIDINES, COMPOSITIONS ET METHODES ASSOCIEES
  申请人：ORTHO MCNEIL PHARM INC

  公开号：WO2000077009A1

  公开（公告）日：2000-12-21

  This invention provides novel dithiepino[6,5-b]pyridines of formulae (I) and (II). These compounds are useful as calcium channel antagonists with cardiovascular, antiasthmatic and antibronchoconstriction activity. Thus, this invention also provides pharmaceutical compositions, as well as methods, for preventing and treating disorders such as hypersensitivity, allergy, asthma, bronchospasm, dysmenorrhea, esophageal spasm, glaucoma, premature labor, urinary tract disorders, gastrointestinal motility disorders and cardiovascular disorders.