(1R,2S,6R,7S)-4-[[(1R)-2-[[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]methyl]cyclohexyl]methyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione

• 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: (1R,2S,6R,7S)-4-[[(1R)-2-[[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]methyl]cyclohexyl]methyl]-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
• 化学式: C₂₈H₃₆N₄O₂S
• 分子量: 492.7
• InChiKey: PQXKDMSYBGKCJA-NHRDDAFGSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  35
• 可旋转键数：
  5
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.68
• 拓扑面积：
  85
• 氢给体数：
  0
• 氢受体数：
  6

文献信息

• PROCESSES FOR MAKING ALKYLATED ARYLPIPERAZINE AND ALKYLATED ARYLPIPERIDINE COMPOUNDS INCLUDING NOVEL INTERMEDIATES
  申请人：Johnson Matthey Public Limited Company

  公开号：US20150361099A1

  公开（公告）日：2015-12-17

  Novel processes, and intermediates, for making alkylated arylpiperazine and alkylated arylpiperidine compounds of the general formulas (I) and (VII), respectively wherein, R 1 and R 2 are individually selected from hydrogen, alkyl, substituted or alkyl; n=0, 1, or 2; Y=NR 3 R 4 , OR 5 , or SR 5 , where R 3 and R 4 are individually selected from acyl or sulfonyl, and where R 5 is aryl or heteroaryl, or heterocyclic; and Ar is an aryl, heteroaryl, or heterocyclic compound.

  用于制备通式(I)和(VII)中所示的烷基化芳基哌嗪和烷基化芳基哌啶化合物的新工艺和中间体，其中，R1和R2分别选择自氢、烷基、取代基或烷基；n=0、1或2；Y=NR3R4、OR5或SR5，其中R3和R4分别选择自酰基或磺酰基，R5是芳基或杂芳基，或杂环烷基；Ar是芳基、杂芳基或杂环烷基。
• PROCESS FOR THE PREPARATION OF LURASIDONE HYDROCHLORIDE
  申请人：EDMOND PHARMA s.r.l.

  公开号：US20140243529A1

  公开（公告）日：2014-08-28

  Disclosed is a new and efficient process for the synthesis with high yields and purity of lurasidone hydrochloride, a medicament which is useful as a psychotropic substance. The process involves the preparation of lurasidone base in a reaction system not containing inorganic salts, followed by conversion of the latter to an addition salt with an organic carboxylic acid, which is finally converted to lurasidone hydrochloride.

  揭示了一种新的高产率和纯度的盐酸吕拉西酮合成方法，该方法用作精神药物。该过程涉及在不含无机盐的反应体系中制备吕拉西酮碱，随后将后者转化为与有机羧酸的加成盐，最终转化为盐酸吕拉西酮。
• US8853395B2
  申请人：——

  公开号：US8853395B2

  公开（公告）日：2014-10-07
• US9790237B2
  申请人：——

  公开号：US9790237B2

  公开（公告）日：2017-10-17