(Rac)-PT2399
HIT212686717
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HIT ID: HIT212686717
Cas No: 1672662-07-5
分子式: C17H10F5NO4S
分子量: 419.32
常用名: (Rac)-PT2399
氢键受体数 (HBA): 4
氢键供体数 (HBD): 1
LogP: 3.715448
IUPAC: 3-[(7-difluoromethanesulfonyl-2,2-difluoro-1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-5-fluorobenzonitrile
IUPAC: 3-[(7-difluoromethanesulfonyl-2,2-difluoro-1-hydroxy-2,3-dihydro-1H-inden-4-yl)oxy]-5-fluorobenzonitrile
SMILES: OC1c2c(CC1(F)F)c(Oc1cc(F)cc(c1)C#N)ccc2S(=O)(=O)C(F)F
SMILES: OC1c2c(CC1(F)F)c(Oc1cc(F)cc(c1)C#N)ccc2S(=O)(=O)C(F)F
InChI key: MXUSGDMIHGLCNC-UHFFFAOYSA-N
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