General Information of the Compound
| Compound ID |
CP0252823
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| Compound Name |
N-cyclopropyl-N-[1-[4-methylsulfonyl-2-(trifluoromethoxy)benzoyl]piperidin-4-yl]-3-(trifluoromethyl)benzenesulfonamide
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| Structure |
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| Formula |
C24H24F6N2O6S2
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| Molecular Weight |
614.586
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| Canonical SMILES |
CS(=O)(=O)c1ccc(C(=O)N2CCC(CC2)N(C2CC2)S(=O)(=O)c2cccc(c2)C(F)(F)F)c(OC(F)(F)F)c1
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| InChI |
InChI=1S/C24H24F6N2O6S2/c1-39(34,35)18-7-8-20(21(14-18)38-24(28,29)30)22(33)31-11-9-17(10-12-31)32(16-5-6-16)40(36,37)19-4-2-3-15(13-19)23(25,26)27/h2-4,7-8,13-14,16-17H,5-6,9-12H2,1H3
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| InChIKey |
XCYNNWRVYVTSDT-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound