1-(2-ethoxy-phenoxy)-3-isopropylamino-propan-2-ol | 27480-08-6

• 英文名称: 1-(2-ethoxy-phenoxy)-3-isopropylamino-propan-2-ol
• 英文别名: (2R)-1-(2-ethoxyphenoxy)-3-(propan-2-ylamino)propan-2-ol
• CAS: 27480-08-6
• 化学式: C₁₄H₂₃NO₃
• 分子量: 253.342
• InChiKey: HQKSPNCPCFCJMA-GFCCVEGCSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  18
• 可旋转键数：
  8
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.57
• 拓扑面积：
  50.7
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1-(2-ethoxy-phenoxy)-3-isopropylamino-propan-2-ol 生成 (R)-2-(2-ethoxy-phenoxymethyl)-morpholine
  参考文献：
  名称：

  Optical isomers of 2-(2-ethoxyphenoxymethyl)tetrahydro-1,4-oxazine (viloxazine) and related compounds

  摘要：

  The optical isomers of 2-(2-ethoxyphenoxymethyl)tetrahydro-1,4-oxazine (viloxazine) and 2-(3-methoxyphenoxymethyl)tetrahydro-1,4-oxazine have been prepared and absolute configurations have been assigned. In their action on the central nervous system the S isomers are at least ten times more potent than the R isomers. The intermediate 4-benzyl-2-(p-toluensulfonyloxymethyl)tetrahydro-1,4-oxazine has been resolved. Its isomers provide a convenient starting point for the preparation of optical isomers of viloxazine analogues of known configuration.

  DOI：

  10.1021/jm00230a021

文献信息

• HOWE R.; LEIGH T.; RAO B. S.; TODD A. H., J. MED. CHEM. <JMCM-AR>, 1976, 19, NO 8, 1074-1076
  作者：HOWE R.、 LEIGH T.、 RAO B. S.、 TODD A. H.

  DOI：——

  日期：——