(NE)-N-[3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-ylidene]hydroxylamine

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶并嘧啶类
• 英文名称: (NE)-N-[3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-2-methyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-ylidene]hydroxylamine
• 化学式: C₂₃H₂₈FN₅O₂
• 分子量: 425.5
• InChiKey: XDFWMDBUYFSLPE-WNAAXNPUSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  31
• 可旋转键数：
  4
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.52
• 拓扑面积：
  77.5
• 氢给体数：
  1
• 氢受体数：
  7

文献信息

• Process for making risperidone and intermediates therefor
  申请人：——

  公开号：US20040097523A1

  公开（公告）日：2004-05-20

  The formation of risperidone is enhanced by the use of enriched Z-isomer oxime intermediate(s) of formula (3) or (7). 1 The oxime(s) can be isomerically enriched by a variety of techniques including the use of the novel acetic acid salt thereof, which affords, inter alia, resolution of the isomers and/or by heat conversion.

  利用富集的Z异构体肟中间体（3）或（7）的使用增强了利培酮的形成。 1 这些肟可以通过各种技术进行异构体富集，包括使用其新颖的乙酸盐，该盐提供了异构体的分离，或通过热转化。
• PROCESS FOR MAKING RISPERIDONE AND INTERMEDIATES THEREFOR
  申请人：Synthon B.V.

  公开号：EP1560814A1

  公开（公告）日：2005-08-10
• US7405298B2
  申请人：——

  公开号：US7405298B2

  公开（公告）日：2008-07-29
• [EN] PROCESS FOR MAKING RISPERIDONE AND INTERMEDIATES THEREFOR<br/>[FR] PROCEDE DE FABRICATION DE LA RISPERIDONE ET DES INTERMEDIAIRES ASSOCIES
  申请人：SYNTHON BV

  公开号：WO2004043923A1

  公开（公告）日：2004-05-27

  The formation of risperidone is enhanced by the use of enriched Z-isomer oxime intermediate(s) of Formula (3) or (7). The oxime(s) can be isomerically enriched by a variety of techniques including the use of the novel acetic acid salt thereof, which affords, inter alia, resolution of the isomers and/or by heat conversion.