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HIT212074921
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HIT212074921
  • HIT ID:HIT212074921
  • Cas No:1216413-74-9
  • 常用名:2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[(1,1,1,2,3,3,3-2H7)propan-2-yl]pentanenitrile hydrochloride
    常用名:2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[(1,1,1,2,3,3,3-2H7)propan-2-yl]pentanenitrile hydrochloride
  • IUPAC:2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[(1,1,1,2,3,3,3-2H7)propan-2-yl]pentanenitrile hydrochloride
    IUPAC:2-(3,4-dimethoxyphenyl)-5-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-2-[(1,1,1,2,3,3,3-2H7)propan-2-yl]pentanenitrile hydrochloride
  • InChI key:OEAFTRIDBHSJDC-GUZHUBCOSA-N
  • 分子式:C26H37ClN2O4
  • 分子量:484.08
  • 氢键供体数 (HBD):1
  • 氢键受体数 (HBA):6
  • LogP:4.6601377
  • SMILES:Cl.[2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])C(CCCNCCc1ccc(OC)c(OC)c1)(C#N)c1ccc(OC)c(OC)c1
    SMILES:Cl.[2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])C(CCCNCCc1ccc(OC)c(OC)c1)(C#N)c1ccc(OC)c(OC)c1
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