cyclohexylmethyl 4-(4-(5-(tert-butoxycarbonylamino)pentylamino)phenyl)-6-ethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate | 1224681-95-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: cyclohexylmethyl 4-(4-(5-(tert-butoxycarbonylamino)pentylamino)phenyl)-6-ethyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
• 英文别名: cyclohexylmethyl 4-[4-[5-(tert-butoxycarbonylamino)pentylamino]phenyl]-6-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate；cyclohexylmethyl 6-ethyl-4-[4-[5-[(2-methylpropan-2-yl)oxycarbonylamino]pentylamino]phenyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
• CAS: 1224681-95-1
• 化学式: C₃₀H₄₆N₄O₅
• 分子量: 542.719
• InChiKey: HDCASTMWYFDJHO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  39
• 可旋转键数：
  15
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.63
• 拓扑面积：
  118
• 氢给体数：
  4
• 氢受体数：
  6

文献信息

• [EN] ANTI VIRAL COMPOUNDS<br/>[FR] COMPOSÉS ANTIVIRAUX
  申请人：PASTEUR INSTITUT KOREA

  公开号：WO2010046780A2

  公开（公告）日：2010-04-29

  There is provided small molecule anti-human immunodeficiency virus (anti-HIV) compounds as well as a phenotypic cell-based high throughput screening (HTS) assay for their identification.