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HIT214320672
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HIT214320672
  • HIT ID:HIT214320672
  • Cas No:946002-48-8
  • 常用名:SAG 21k
  • IUPAC:3-chloro-4,7-difluoro-N-{[2-methoxy-5-(pyridin-4-yl)phenyl]methyl}-N-[(1r,4r)-4-(methylamino)cyclohexyl]-1-benzothiophene-2-carboxamide
    IUPAC:3-chloro-4,7-difluoro-N-{[2-methoxy-5-(pyridin-4-yl)phenyl]methyl}-N-[(1r,4r)-4-(methylamino)cyclohexyl]-1-benzothiophene-2-carboxamide
  • InChI key:YVIFQUJDZSAFKG-MEMLXQNLSA-N
  • 分子式:C29H28ClF2N3O2S
  • 分子量:556.07
  • 氢键供体数 (HBD):
  • 氢键受体数 (HBA):
  • LogP:
  • SMILES:CN[C@H]1CC[C@@H](CC1)N(Cc1cc(ccc1OC)-c1ccncc1)C(=O)c1sc2c(F)ccc(F)c2c1Cl |wU:5.8,wD:2.1,(-10.41,1.36,;-9.64,.03,;-8.1,.03,;-7.33,-1.3,;-5.79,-1.3,;-5.02,.03,;-5.79,1.36,;-7.33,1.36,;-3.48,.03,;-2.71,1.36,;-3.48,2.7,;-5.02,2.7,;-5.79,4.03,;-5.02,5.37,;-3.48,5.37,;-2.71,4.03,;-1.17,4.03,;-.4,5.37,;-7.33,4.03,;-8.1,2.7,;-9.64,2.7,;-10.41,4.03,;-9.64,5.37,;-8.1,5.37,;-2.71,-1.3,;-3.48,-2.64,;-1.17,-1.3,;-.27,-.06,;1.2,-.53,;2.53,.24,;2.53,1.78,;3.86,-.53,;3.86,-2.07,;2.53,-2.84,;2.53,-4.38,;1.2,-2.07,;-.27,-2.55,;-.74,-4.01,)|
    SMILES:CN[C@H]1CC[C@@H](CC1)N(Cc1cc(ccc1OC)-c1ccncc1)C(=O)c1sc2c(F)ccc(F)c2c1Cl |wU:5.8,wD:2.1,(-10.41,1.36,;-9.64,.03,;-8.1,.03,;-7.33,-1.3,;-5.79,-1.3,;-5.02,.03,;-5.79,1.36,;-7.33,1.36,;-3.48,.03,;-2.71,1.36,;-3.48,2.7,;-5.02,2.7,;-5.79,4.03,;-5.02,5.37,;-3.48,5.37,;-2.71,4.03,;-1.17,4.03,;-.4,5.37,;-7.33,4.03,;-8.1,2.7,;-9.64,2.7,;-10.41,4.03,;-9.64,5.37,;-8.1,5.37,;-2.71,-1.3,;-3.48,-2.64,;-1.17,-1.3,;-.27,-.06,;1.2,-.53,;2.53,.24,;2.53,1.78,;3.86,-.53,;3.86,-2.07,;2.53,-2.84,;2.53,-4.38,;1.2,-2.07,;-.27,-2.55,;-.74,-4.01,)|
  • SAG 21k 是一种可透过血脑屏障且具有口服生物活性和有效性的 Hedgehog 信号激活剂,可用于研究软骨再生。
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
    99.51%
    ¥ 953.00
    1

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