(4-methoxyphenyl)[4-(2-pyrrolidinoethoxy)phenyl](5,6,7,8-tetrahydronaphth-1-yl)methane hydrochloride

• 分子结构分类: 有机化合物 - 苯类化合物 - 四氢化萘
• 英文名称: (4-methoxyphenyl)[4-(2-pyrrolidinoethoxy)phenyl](5,6,7,8-tetrahydronaphth-1-yl)methane hydrochloride
• 英文别名: 1-[2-[4-[(4-Methoxyphenyl)-(5,6,7,8-tetrahydronaphthalen-1-yl)methyl]phenoxy]ethyl]pyrrolidine;hydrochloride
• 化学式: C₃₀H₃₅NO₂*ClH
• 分子量: 478.074
• InChiKey: CKQFHQJOQVKYMY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.65
• 重原子数：
  34
• 可旋转键数：
  8
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  21.7
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  1-萘甲酸 在 镍 sodium tetrahydroborate 、 三氯化铝 、 PPA 、 氢气 、 四氯化钛 、 potassium carbonate 作用下， 以 甲醇 、 丙酮 、 正戊烷 、 苯 为溶剂， 80.0 ℃ 、344.74 kPa 条件下， 生成 (4-methoxyphenyl)[4-(2-pyrrolidinoethoxy)phenyl](5,6,7,8-tetrahydronaphth-1-yl)methane hydrochloride
  参考文献：
  名称：

  Diaryl naphthyl methanes a novel class of anti-implantation agents

  摘要：

  Diaryl naphthyl methanes and the corresponding 1, 2, 3, 4- and 5, 6, 7, 8-tetrahydro naphthyl methane derivatives have been synthesized as novel estrogen receptor binding ligands. The secondary and tertiary amino alkoxy derivatives of diaryl naphthyl and tetrahydro naphthyl methane interact with the estrogen receptor to elicit promising estrogenic, antiestrogenic and implantation inhibition activities in rats. The most active compounds in this series are 7, 9 and 20, cent percent active in preventing implantation in rats at 2.5 mgkg(-1) dose. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmc.2003.12.015

文献信息

• US6610705B1
  申请人：——

  公开号：US6610705B1

  公开（公告）日：2003-08-26
• Diaryl naphthyl methanes a novel class of anti-implantation agents
  作者：Neeta Srivastava、Sangita、S Ray、M.M Singh、Anila Dwivedi、Atul Kumar

  DOI：10.1016/j.bmc.2003.12.015

  日期：2004.3

  Diaryl naphthyl methanes and the corresponding 1, 2, 3, 4- and 5, 6, 7, 8-tetrahydro naphthyl methane derivatives have been synthesized as novel estrogen receptor binding ligands. The secondary and tertiary amino alkoxy derivatives of diaryl naphthyl and tetrahydro naphthyl methane interact with the estrogen receptor to elicit promising estrogenic, antiestrogenic and implantation inhibition activities in rats. The most active compounds in this series are 7, 9 and 20, cent percent active in preventing implantation in rats at 2.5 mgkg(-1) dose. (C) 2004 Elsevier Ltd. All rights reserved.