1--aminomethyl-6.7-dimethoxyisochro-man | 70070-04-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 英文名称: 1--aminomethyl-6.7-dimethoxyisochro-man
• 英文别名: 1-(((3,4-Dihydro-6,7-dimethoxy-1H-2-benzopyran-1-yl)methyl)methylamino)-3-phenoxy-2-propanol；1-[(6,7-dimethoxy-3,4-dihydro-1H-isochromen-1-yl)methyl-methylamino]-3-phenoxypropan-2-ol
• CAS: 70070-04-1
• 化学式: C₂₂H₂₉NO₅
• 分子量: 387.476
• InChiKey: KYJOMABGOCCGNP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  28
• 可旋转键数：
  9
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  60.4
• 氢给体数：
  1
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  1-methylaminomethyl-6,7-dimethoxyisochroman 、 苯基缩水甘油醚 以56%的产率得到
  参考文献：
  名称：

  KUMAR A.; KHANNA J. M.; JAIN P. C.; ANAND N., INDIAN J. CHEM., 1978, B 16, NO 9, 793-796

  摘要：

  DOI：

文献信息

• TARGETED DRUG RESCUE WITH NOVEL COMPOSITIONS, COMBINATIONS, AND METHODS THEREOF
  申请人：VEPACHEDU SREENIVASARAO

  公开号：US20200069674A1

  公开（公告）日：2020-03-05

  Compounds of Formula I, pharmaceutically acceptable salts thereof, enantiomers thereof, metabolites thereof, derivatives thereof, prodrugs thereof, acid addition salts thereof, pharmaceutically acceptable salts thereof, or N-oxides thereof; or a combination thereof; processes and intermediates for preparation thereof, compositions thereof, and uses thereof; are provided. Pharmaceutical compositions comprising a compound of Formula I, or enantiomers thereof, metabolites thereof, derivatives thereof, prodrugs thereof, acid addition salts thereof, pharmaceutically acceptable salts thereof, or N-oxides thereof; or a combination thereof; wherein the compound is a double and/or triple agent or ligand for CYP2D6, 5-HT2A, and/or 5HT2C receptors, and/or acetylcholinesterase are provided.
• KUMAR A.; KHANNA J. M.; JAIN P. C.; ANAND N., INDIAN J. CHEM., 1978, B 16, NO 9, 793-796
  作者：KUMAR A.、 KHANNA J. M.、 JAIN P. C.、 ANAND N.

  DOI：——

  日期：——