[5-[3-[(4R,5R)-3,3-dibutyl-7-(dimethylamino)-4-hydroxy-1,1-dioxo-4,5-dihydro-2H-1lambda6,2-benzothiazepin-5-yl]anilino]-5-oxopentyl]-triethylazanium;2,2,2-trifluoroacetate

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [5-[3-[(4R,5R)-3,3-dibutyl-7-(dimethylamino)-4-hydroxy-1,1-dioxo-4,5-dihydro-2H-1lambda6,2-benzothiazepin-5-yl]anilino]-5-oxopentyl]-triethylazanium;2,2,2-trifluoroacetate
• 英文别名: [5-[3-[(4R,5R)-3,3-dibutyl-7-(dimethylamino)-4-hydroxy-1,1-dioxo-4,5-dihydro-2H-1λ6,2-benzothiazepin-5-yl]anilino]-5-oxopentyl]-triethylazanium;2,2,2-trifluoroacetate
• 化学式: C38H59F3N4O6S
• 分子量: 757.0
• InChiKey: FQABKRUUFYAYFH-SWIBWIMJSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.94
• 重原子数：
  52
• 可旋转键数：
  17
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.63
• 拓扑面积：
  147
• 氢给体数：
  3
• 氢受体数：
  11

文献信息

• 1,2-BENZOTHIAZEPINES FOR THE TREATMENT OF HYPERLIPIDEMIC DISEASES
  申请人：G.D. Searle LLC

  公开号：EP1155007A2

  公开（公告）日：2001-11-21
• [EN] NOVEL 1,2-BENZOTHIAZEPINES HAVING ACTIVITY AS INHIBITORS OF ILEAL BILE ACID TRANSPORT AND TAUROCHOLATE UPTAKE<br/>[FR] NOUVELLES BENZOTHIAZEPINES-1,2 PRESENTANT UNE ACTIVITE D'INHIBITION DE TRANSPORT D'ACIDE BILIAIRE ILEAL ET D'ABSORPTION DE TAUROCHOLATE
  申请人：SEARLE & CO

  公开号：WO2000047568A2

  公开（公告）日：2000-08-17

  Novel 1,1-dioxido-1,2-benzothiazepines, derivatives and analogs thereof, pharmaceutical compositions containing them, and their use in medicine, particularly in the prophylaxis and/or treatment of hyperlipidemic diseases, conditions and/or disorders, such as those associated with atherosclerosis and/or hypercholesterolemia.