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HIT217737176
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HIT217737176
  • HIT ID:HIT217737176
  • Cas No:
  • 常用名:(4aS,4bS,6aS,7S,9aS,9bS,11aR)-3-fluoro-N-{1H-imidazo[4,5-b]pyridin-2-ylmethyl}-1,4a,6a-trimethyl-2-oxo-4bH,5H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-indeno[5,4-f]quinoline-7-carboxamide; formic acid
    常用名:(4aS,4bS,6aS,7S,9aS,9bS,11aR)-3-fluoro-N-{1H-imidazo[4,5-b]pyridin-2-ylmethyl}-1,4a,6a-trimethyl-2-oxo-4bH,5H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-indeno[5,4-f]quinoline-7-carboxamide; formic acid
  • IUPAC:(4aS,4bS,6aS,7S,9aS,9bS,11aR)-3-fluoro-N-({1H-imidazo[4,5-b]pyridin-2-yl}methyl)-1,4a,6a-trimethyl-2-oxo-1H,2H,4aH,4bH,5H,6H,6aH,7H,8H,9H,9aH,9bH,10H,11H,11aH-indeno[5,4-f]quinoline-7-carboxamide; formic acid
    IUPAC:(4aS,4bS,6aS,7S,9aS,9bS,11aR)-3-fluoro-N-({1H-imidazo[4,5-b]pyridin-2-yl}methyl)-1,4a,6a-trimethyl-2-oxo-1H,2H,4aH,4bH,5H,6H,6aH,7H,8H,9H,9aH,9bH,10H,11H,11aH-indeno[5,4-f]quinoline-7-carboxamide; formic acid
  • InChI key:OYUGSILFKJWCTR-LYFPBYORSA-N
  • 分子式:C28H36FN5O4
  • 分子量:525.625
  • 氢键供体数 (HBD):
  • 氢键受体数 (HBA):
  • LogP:
  • SMILES:OC=O.[H][C@@]12CC[C@H](C(=O)NCc3nc4ncccc4[nH]3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@@]2([H])N(C)C(=O)C(F)=C[C@]12C
    SMILES:OC=O.[H][C@@]12CC[C@H](C(=O)NCc3nc4ncccc4[nH]3)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])CC[C@@]2([H])N(C)C(=O)C(F)=C[C@]12C
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