General Information of the Compound
| Compound ID |
CP0407552
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| Compound Name |
N-(2,4-difluorophenyl)-2-[N-(4-methylphenyl)sulfonyl-3-(trifluoromethyl)anilino]acetamide
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| Structure |
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| Formula |
C22H17F5N2O3S
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| Molecular Weight |
484.446
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| Canonical SMILES |
Cc1ccc(cc1)S(=O)(=O)N(CC(=O)Nc1ccc(F)cc1F)c1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C22H17F5N2O3S/c1-14-5-8-18(9-6-14)33(31,32)29(17-4-2-3-15(11-17)22(25,26)27)13-21(30)28-20-10-7-16(23)12-19(20)24/h2-12H,13H2,1H3,(H,28,30)
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| InChIKey |
RAFBFRPGEXEOCR-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