General Information of the Compound
| Compound ID |
CP0963651
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| Compound Name |
N-(3-chloro-4-(trifluoromethoxy)benzyl)-3-fluoro-4-(N-(5-fluoropyrimidin-2-yl)sulfamoyl)benzamide
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| Structure |
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| Formula |
C19H12ClF5N4O4S
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| Molecular Weight |
522.839
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| Canonical SMILES |
O=C(NCc1ccc(OC(F)(F)F)c(Cl)c1)c1ccc(S(=O)(=O)Nc2ncc(F)cn2)c(F)c1
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| InChI |
InChI=1S/C19H12ClF5N4O4S/c20-13-5-10(1-3-15(13)33-19(23,24)25)7-26-17(30)11-2-4-16(14(22)6-11)34(31,32)29-18-27-8-12(21)9-28-18/h1-6,8-9H,7H2,(H,26,30)(H,27,28,29)
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| InChIKey |
CNDMCBBYQNZMLD-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