1-[8-Methyl-3-[4-(2-methylprop-1-enyl)phenyl]-8-azabicyclo[3.2.1]octan-2-yl]propan-1-one

• 分子结构分类: 有机化合物 - 生物碱及其衍生物 - 托烷生物碱
• 英文名称: 1-[8-Methyl-3-[4-(2-methylprop-1-enyl)phenyl]-8-azabicyclo[3.2.1]octan-2-yl]propan-1-one
• 化学式: C₂₁H₂₉NO
• 分子量: 311.5
• InChiKey: YCUKXYINIGXATB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  23
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  20.3
• 氢给体数：
  0
• 氢受体数：
  2

文献信息

• US6013242A
  申请人：——

  公开号：US6013242A

  公开（公告）日：2000-01-11
• [EN] TROPANE DERIVATIVES AS SEROTONIN TRANSPORTER ANTAGONISTS<br/>[FR] DERIVES DE TROPANE UTILISES COMME ANTAGONISTES DU TRANSPORTEUR DE LA SEROTONINE
  申请人：UNIV WAKE FOREST

  公开号：WO2000044747A1

  公开（公告）日：2000-08-03

  Biologically active derivatives of the tropane ring system are provided having formula (1) wherein R1 is selected from the group consisting of hydrogen and C1 to C8 alykl; R2 is selected from the group consisting of hydrogen, iodo, radioisotopic halo, C1 to C8 alkyl and tri lower alkyl (C1 to C8) tin; and R1 and R2 may be fused by a -N(Me)CH=CH- to form a pyrrole ring; R3 is selected from the group consisting of hydrogen, iodo, or C1 to C8 alkyl; R4 is selected from the group consisting of hydrogen and C1 to C8 alkyl; and, R5 is selected from the group consisting of hydrogen or C1 to C8 alkyl, and salts, solvates and hydrates thereof, which selectively bind either to the 5-HT or DA reuptake site, leading to compounds which have use for the treatment of clinical depression, attention deficit disorder, obesity and cocaine addiction.