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(1R,9S,10S)-17-(cyclopropylmethyl)-4-methoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-13-one

中文名称
——
中文别名
——
英文名称
(1R,9S,10S)-17-(cyclopropylmethyl)-4-methoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-13-one
英文别名
——
(1R,9S,10S)-17-(cyclopropylmethyl)-4-methoxy-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-13-one化学式
CAS
——
化学式
C21H27NO2
mdl
——
分子量
325.4
InChiKey
TVSUSZBGGNVGHO-HLAWJBBLSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    3
  • 重原子数:
    24
  • 可旋转键数:
    3
  • 环数:
    5.0
  • sp3杂化的碳原子比例:
    0.67
  • 拓扑面积:
    29.5
  • 氢给体数:
    0
  • 氢受体数:
    3

文献信息

  • Spirocyclic Morphinans and Their Use
    申请人:Purdue Pharma L.P.
    公开号:US20140179724A1
    公开(公告)日:2014-06-26
    The application is directed to compounds of Formula I′-A especially to compounds of Formula I-A and pharmaceutically acceptable salts and solvates thereof, wherein R 1a -R 5a , Y, Z are defined as set forth in the specification. The invention is also directed to use of compounds of Formula I′-A, and especially compounds of Formula I-A, to treat disorders responsive to the modulation of one or more opioid receptors, or as synthetic intermediates. Certain compounds of the present invention are especially useful for treating pain.
  • SPIROCYCLIC MORPHINANS AND THEIR USE
    申请人:Purdue Pharma L.P.
    公开号:US20150203495A1
    公开(公告)日:2015-07-23
    The application is directed to compounds of Formula I′-A and especially to compounds of Formula I-A and pharmaceutically acceptable salts and solvates thereof, wherein R 1a -R 5a , Y, Z a are defined as set forth in the specification. The invention is also directed to use of compounds of Formula I′-A, and especially compounds of Formula I-A, to treat disorders responsive to the modulation of one or more opioid receptors, or as synthetic intermediates. Certain compounds of the present invention are especially useful for treating pain.
  • US8987287B2
    申请人:——
    公开号:US8987287B2
    公开(公告)日:2015-03-24
  • US9273048B2
    申请人:——
    公开号:US9273048B2
    公开(公告)日:2016-03-01
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