2-Isopropyl-5-methoxy-indan-1-one | 910050-31-6

• 分子结构分类: 有机化合物 - 苯类化合物 - 茚满类
• 英文名称: 2-Isopropyl-5-methoxy-indan-1-one
• 英文别名: 5-Methoxy-2-propan-2-yl-2,3-dihydroinden-1-one
• CAS: 910050-31-6
• 化学式: C₁₃H₁₆O₂
• 分子量: 204.269
• InChiKey: STQDOGPKMLPEHT-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  15
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  26.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-Isopropyl-5-methoxy-indan-1-one 在 盐酸 、 三溴化硼 、 溶剂黄146 、 1,8-二氮杂双环[5.4.0]十一碳-7-烯 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 生成 7-Hydroxy-9a-isopropyl-4-methyl-1,2,9,9a-tetrahydro-fluoren-3-one
  参考文献：
  名称：

  The discovery of tetrahydrofluorenones as a new class of estrogen receptor β-subtype selective ligands

  摘要：

  Synthesis and derivatization of a series of substituted tetrahydrofluorenone analogs giving potent, ERbeta subtype selective ligands are described. Several analogs possessing ERbeta binding affinities comparable to 17beta-estradiol but with greater than 75-fold selectivity over ERalpha are reported.

  DOI：

  10.1016/j.bmcl.2006.03.098
• 作为产物：
  描述：

  2-碘代丙烷 、 5-甲氧基-1-茚酮 在 sodium hydride 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 2-Isopropyl-5-methoxy-indan-1-one
  参考文献：
  名称：

  The discovery of tetrahydrofluorenones as a new class of estrogen receptor β-subtype selective ligands

  摘要：

  Synthesis and derivatization of a series of substituted tetrahydrofluorenone analogs giving potent, ERbeta subtype selective ligands are described. Several analogs possessing ERbeta binding affinities comparable to 17beta-estradiol but with greater than 75-fold selectivity over ERalpha are reported.

  DOI：

  10.1016/j.bmcl.2006.03.098

文献信息

• NEUROGENESIS BY MUSCARINIC RECEPTOR MODULATION
  申请人：Barlow Carrolee

  公开号：US20110319386A1

  公开（公告）日：2011-12-29

  The instant disclosure describes methods for treating diseases and conditions of the central and peripheral nervous system by stimulating or increasing neurogenesis. The disclosure includes compositions and methods based on muscarinic receptor modulation, such as via inhibition of acetylcholine esterase (AChE) activity, alone or in combination with another neurogenic agent to stimulate or activate the formation of new nerve cells.