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HIT214432956
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HIT214432956
  • HIT ID:HIT214432956
  • Cas No:2793405-20-4
  • 常用名:SOS1-IN-14
  • IUPAC:1-[(7S)-17-{[(1R)-1-[3-(difluoromethyl)-2-fluorophenyl]ethyl]amino}-15-methyl-10-oxa-2,5,14,16-tetraazatetracyclo[9.8.0.0^{2,7}.0^{13,18}]nonadeca-1(19),11,13,15,17-pentaene-5-carbonyl]cyclopropane-1-carbonitrile
    IUPAC:1-[(7S)-17-{[(1R)-1-[3-(difluoromethyl)-2-fluorophenyl]ethyl]amino}-15-methyl-10-oxa-2,5,14,16-tetraazatetracyclo[9.8.0.0^{2,7}.0^{13,18}]nonadeca-1(19),11,13,15,17-pentaene-5-carbonyl]cyclopropane-1-carbonitrile
  • InChI key:UVNQICXVXBBWBT-AEFFLSMTSA-N
  • 分子式:C29H29F3N6O2
  • 分子量:550.586
  • 氢键供体数 (HBD):
  • 氢键受体数 (HBA):
  • LogP:
  • SMILES:[H][C@]12CN(CCN1c1cc3c(N[C@H](C)c4cccc(C(F)F)c4F)nc(C)nc3cc1OCC2)C(=O)C1(CC1)C#N
    SMILES:[H][C@]12CN(CCN1c1cc3c(N[C@H](C)c4cccc(C(F)F)c4F)nc(C)nc3cc1OCC2)C(=O)C1(CC1)C#N
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