(Z)-[4-(3-dimethylaminopropylidene)-9,10-dihydro-4H-3-thiabenzo[f]lazulen-6-yl]acetic acid hydrochloride | 1206618-36-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 环七噻吩
• 英文名称: (Z)-[4-(3-dimethylaminopropylidene)-9,10-dihydro-4H-3-thiabenzo[f]lazulen-6-yl]acetic acid hydrochloride
• 英文别名: 2-[(2Z)-2-[3-(dimethylamino)propylidene]-4-thiatricyclo[8.4.0.03,7]tetradeca-1(10),3(7),5,11,13-pentaen-13-yl]acetic acid;hydrochloride
• CAS: 1206618-36-1
• 化学式: C₂₀H₂₃NO₂S*ClH
• 分子量: 377.935
• InChiKey: MQQRSQIBVPCZNX-JEDQHDOISA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.28
• 重原子数：
  25
• 可旋转键数：
  5
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  68.8
• 氢给体数：
  2
• 氢受体数：
  4

文献信息

• AMINOPROPYLIDENE DERIVATIVE
  申请人：Higashiura Kunihiko

  公开号：US20110124856A1

  公开（公告）日：2011-05-26

  An aminopropylidene derivative having excellent histamine receptor antagonistic action, a compound which is useful as a pharmaceutical composition, especially as an active ingredient, having alleviated side effects in the central nervous system is described. In the aminopropylidene derivative, R 1 and R 2 , which may be identical or different, stand for a hydrogen, a substituted carbonyl, a substituted carbonylalkyl, and acrylic acid, excluding a case where both are hydrogen; R 3 and R 4 , which may be identical or different, stand for hydrogen, an alkyl which may be substituted with phenyl, or the like; A stands for unsubstituted or an oxo; B stands for a carbon or an oxygen; one of X and Y stands for a carbon and the other stands for a sulfur, a broken line part stands for a single bond or a double bond, and a wavy line stands for cis-form and/or trans-form.

  描述了一种具有出色的组胺受体拮抗作用的氨基丙烯酰衍生物，该化合物可用作制药组合物，特别是作为活性成分，具有减轻中枢神经系统副作用的作用。在氨基丙烯酰衍生物中，R1和R2可以相同或不同，代表氢、取代的羰基、取代的羰基烷基和丙烯酸，不包括两者都是氢的情况；R3和R4可以相同或不同，代表氢、可以用苯基等取代的烷基；A代表未取代或氧代；B代表碳或氧；X和Y中的一个代表碳，另一个代表硫，断线部分代表单键或双键，波浪线代表顺式和/或反式。
• US8653285B2
  申请人：——

  公开号：US8653285B2

  公开（公告）日：2014-02-18