(S)-N-((S)-2-((5S,8aR)-7-(4-chlorophenethyl)-5-(4-methylbenzyl)-3,6-dioxohexahydroimidazo[1,2-a]pyrazin-1(5H)-yl)-1-cyclohexyl-2-oxoethyl)-2-(methylamino)propanamide | 1319210-96-2

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: (S)-N-((S)-2-((5S,8aR)-7-(4-chlorophenethyl)-5-(4-methylbenzyl)-3,6-dioxohexahydroimidazo[1,2-a]pyrazin-1(5H)-yl)-1-cyclohexyl-2-oxoethyl)-2-(methylamino)propanamide
• 英文别名: (2S)-N-[(1S)-2-[(5S,8aR)-7-[2-(4-chlorophenyl)ethyl]-5-[(4-methylphenyl)methyl]-3,6-dioxo-2,5,8,8a-tetrahydroimidazo[1,2-a]pyrazin-1-yl]-1-cyclohexyl-2-oxoethyl]-2-(methylamino)propanamide
• CAS: 1319210-96-2
• 化学式: C₃₄H₄₄ClN₅O₄
• 分子量: 622.207
• InChiKey: PNZUOSLUSPVGKK-KQHSXCACSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  44
• 可旋转键数：
  10
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  102
• 氢给体数：
  2
• 氢受体数：
  5

文献信息

• [EN] IMIDAZOPYRAZINONE DERIVATIVES WITH APOPTOSIS INDUCING ACTIVITY ON CELLS<br/>[FR] DÉRIVÉS IMIDAZOPYRAZINONES AVEC ACTIVITÉ INDUISANT APOPTOSE SUR CELLULES
  申请人：HANMI HOLDINGS CO LTD

  公开号：WO2011090317A2

  公开（公告）日：2011-07-28

  Provided is a pharmaceutical composition comprising, as an active ingredient, an imidazopyrazinone derivative of formula (I), a pharmaceutically acceptable salt, an isomer, a hydrate, and a solvate thereof, which is effective in the prevention and treatment of cancer, inflammation, autoimmune diseases and neurodegenerative disorders which are induced by the overexpression of inhibitor of apoptosis proteins (IAPs).