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HIT212713225
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HIT212713225
  • HIT ID:HIT212713225
  • Cas No:1257994-15-2
  • 常用名:OXA-11
  • 别名:OXA11, FAK-IN-16
  • IUPAC:diethyl [(3-methoxy-4-{[4-({2-methyl-3-oxo-7-[(1r,4r)-4-(4-methylpiperazin-1-yl)cyclohexyl]-2,3-dihydro-1H-isoindol-4-yl}amino)-5-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)methyl]phosphonate
    IUPAC:diethyl [(3-methoxy-4-{[4-({2-methyl-3-oxo-7-[(1r,4r)-4-(4-methylpiperazin-1-yl)cyclohexyl]-2,3-dihydro-1H-isoindol-4-yl}amino)-5-(trifluoromethyl)pyrimidin-2-yl]amino}phenyl)methyl]phosphonate
  • InChI key:HZOFIHCVZSUCBZ-DIVCQZSQSA-N
  • 分子式:C37H49F3N7O5P
  • 分子量:759.812
  • 氢键供体数 (HBD):2
  • 氢键受体数 (HBA):9
  • LogP:6.4020834
  • SMILES:CCOP(=O)(Cc1ccc(Nc2ncc(c(Nc3ccc([C@H]4CC[C@@H](CC4)N4CCN(C)CC4)c4CN(C)C(=O)c34)n2)C(F)(F)F)c(OC)c1)OCC |wU:24.27,wD:21.20,(22.12,5.39,;20.79,6.16,;19.46,5.39,;18.12,6.16,;17.35,4.83,;16.79,6.93,;15.46,6.16,;15.46,4.62,;14.12,3.85,;12.79,4.62,;11.46,3.85,;10.12,4.62,;10.12,6.16,;8.79,6.93,;7.45,6.16,;7.45,4.62,;6.12,3.85,;6.12,2.31,;7.45,1.54,;7.45,,;6.12,-.77,;6.12,-2.31,;4.79,-3.08,;4.79,-4.62,;6.12,-5.39,;7.45,-4.62,;7.45,-3.08,;6.12,-6.93,;7.45,-7.7,;7.45,-9.24,;6.12,-10.01,;6.12,-11.55,;4.79,-9.24,;4.79,-7.7,;4.79,,;3.32,-.48,;2.42,.77,;.88,.77,;3.32,2.02,;2.85,3.48,;4.79,1.54,;8.79,3.85,;6.12,6.93,;4.79,7.7,;6.89,8.26,;5.35,5.6,;12.79,6.16,;11.46,6.93,;11.46,8.47,;14.12,6.93,;18.89,7.49,;20.43,7.49,;21.2,8.83,)|
    SMILES:CCOP(=O)(Cc1ccc(Nc2ncc(c(Nc3ccc([C@H]4CC[C@@H](CC4)N4CCN(C)CC4)c4CN(C)C(=O)c34)n2)C(F)(F)F)c(OC)c1)OCC |wU:24.27,wD:21.20,(22.12,5.39,;20.79,6.16,;19.46,5.39,;18.12,6.16,;17.35,4.83,;16.79,6.93,;15.46,6.16,;15.46,4.62,;14.12,3.85,;12.79,4.62,;11.46,3.85,;10.12,4.62,;10.12,6.16,;8.79,6.93,;7.45,6.16,;7.45,4.62,;6.12,3.85,;6.12,2.31,;7.45,1.54,;7.45,,;6.12,-.77,;6.12,-2.31,;4.79,-3.08,;4.79,-4.62,;6.12,-5.39,;7.45,-4.62,;7.45,-3.08,;6.12,-6.93,;7.45,-7.7,;7.45,-9.24,;6.12,-10.01,;6.12,-11.55,;4.79,-9.24,;4.79,-7.7,;4.79,,;3.32,-.48,;2.42,.77,;.88,.77,;3.32,2.02,;2.85,3.48,;4.79,1.54,;8.79,3.85,;6.12,6.93,;4.79,7.7,;6.89,8.26,;5.35,5.6,;12.79,6.16,;11.46,6.93,;11.46,8.47,;14.12,6.93,;18.89,7.49,;20.43,7.49,;21.2,8.83,)|
  • OXA-11 (FAK-IN-16) 是一种具有口服活性、选择性粘着斑激酶 (FAK) 抑制剂,具有抗肿瘤活性,抑制磷酸酪氨酸 397 位点的 FAK 磷酸化, 以剂量依赖性方式抑制 TOV21G 肿瘤生长,可用于研究癌症。
市场产品/服务共显示1个结果
  • 供应商
    TargetMolSC
    规格
    货期
    1-3天
    纯度
    99.20%
    ¥ 12,500.00
    1

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