N-(3,4-Dimethoxyphenethyl)-3-(4-((3-isopropyl-1-methyl-1H-indol-2-yl)sulfonyl)phenoxy)-N-methylpropan-1-amine oxalate | 121346-33-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: N-(3,4-Dimethoxyphenethyl)-3-(4-((3-isopropyl-1-methyl-1H-indol-2-yl)sulfonyl)phenoxy)-N-methylpropan-1-amine oxalate
• 英文别名: N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-3-[4-(1-methyl-3-propan-2-ylindol-2-yl)sulfonylphenoxy]propan-1-amine;oxalic acid
• CAS: 121346-33-6
• 化学式: C34H42N2O9S
• 分子量: 654.8
• InChiKey: MZWPPDAHWIKZID-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.25
• 重原子数：
  46
• 可旋转键数：
  14
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  153
• 氢给体数：
  2
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  SR-33805 生成 N-(3,4-Dimethoxyphenethyl)-3-(4-((3-isopropyl-1-methyl-1H-indol-2-yl)sulfonyl)phenoxy)-N-methylpropan-1-amine oxalate
  参考文献：
  名称：

  Org. Lett. 2018, 20, 648-651

  摘要：

  DOI：

文献信息

• J. Med. Chem. 1993, 36, 1425-1433
  作者：

  DOI：——

  日期：——
• METHOD FOR DRUG SCREENING AND CHARACTERIZATION BY ION FLUX ANALYSIS
  申请人：Cedars-Sinai Medical Center

  公开号：EP1828830A1

  公开（公告）日：2007-09-05
• Method for Drug Screening and Characterization by Calcium Flux
  申请人：Ben-Shlomo Anat

  公开号：US20080253641A1

  公开（公告）日：2008-10-16

  The instrumentation and methods described herein are based on imaging and measuring single cell dose response by fluorescent ion imaging that records live cell responses to drug doses with no apparent damage to the cells or toxic side effects. Dose response curves and other pharmacological parameters can be computed by imaging and measuring oscillation changes for each dose and each cell. Large variability of cellular responses under the same experimental conditions indicates that pharmacological benchmarks are determined by statistical distribution of cells and cellular physiology. The instrumentation and methods described herein provide a means of measuring statistical variability of cell populations for improved screening and development methods for drugs.
• US5565484A
  申请人：——

  公开号：US5565484A

  公开（公告）日：1996-10-15
• US8709804B2
  申请人：——

  公开号：US8709804B2

  公开（公告）日：2014-04-29