N-[1-(3,4-Dimethoxy-phenyl)-cyclohexylmethyl]-4-methoxy-3-nitro-benzamide

• 分子结构分类: 有机化合物 - 生物碱及其衍生物 - 石蒜科生物碱
• 英文名称: N-[1-(3,4-Dimethoxy-phenyl)-cyclohexylmethyl]-4-methoxy-3-nitro-benzamide
• 英文别名: N-[[1-(3,4-dimethoxyphenyl)cyclohexyl]methyl]-4-methoxy-3-nitrobenzamide
• 化学式: C23H28N2O6
• 分子量: 428.5
• InChiKey: ABVCHPLRGDKQBL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.8
• 重原子数：
  31
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  103
• 氢给体数：
  1
• 氢受体数：
  6

文献信息

• SMALL-MOLECULES FOR TREATING CANCER AND ABNORMAL CELL PROLIFERATION DISORDERS
  申请人：Neamati Nouri

  公开号：US20070203224A1

  公开（公告）日：2007-08-30

  Novel compounds and compositions that can be used to bind tubulin, prevent tubulin polymerization, inhibit cell growth, arrest cell cycle, cause cell death, or treat cancer or abnormal cell proliferation disorders. Also disclosed are methods for identifying, synthesizing, and using such compounds.
• [EN] SMALL MOLECULES FOR TREATING CANCER AND ABNORMAL CELL PROLIFERATION DISORDERS<br/>[FR] PETITES MOLÉCULES POUR TRAITER UN CANCER ET DES TROUBLES DE PROLIFÉRATION CELLULAIRE ANORMALE
  申请人：UNIV SOUTHERN CALIFORNIA

  公开号：WO2007081966A2

  公开（公告）日：2007-07-19

  [EN] Novel compounds and compositions that can be used to bind tubulin, prevent tubulin polymerization, inhibit cell growth, arrest cell cyle, cause cell death, or treat cancer or abnormal cell proliferation disorders. Also disclosed are methods for identifying, synthesizing, and using such compounds.
  [FR] L'invention concerne de nouveaux composés et compositions qui peuvent être utilisés pour lier la tubuline, empêcher la polymérisation de la tubuline, inhiber la croissance cellulaire, arrêter un cycle cellulaire, causer une mort cellulaire ou traiter un cancer ou des troubles d'une prolifération cellulaire anormale. Des méthodes pour identifier, synthétiser et utiliser de tels composés sont aussi décrites.