General Information of the Compound
| Compound ID |
CP0545570
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| Compound Name |
N-(2-methoxy-5-methylphenyl)-2-[4-(4-methylpiperidin-1-yl)sulfonylpiperazin-1-yl]acetamide
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| Structure |
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| Formula |
C20H32N4O4S
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| Molecular Weight |
424.567
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| Canonical SMILES |
COc1ccc(C)cc1NC(=O)CN1CCN(CC1)S(=O)(=O)N1CCC(C)CC1
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| InChI |
InChI=1S/C20H32N4O4S/c1-16-6-8-23(9-7-16)29(26,27)24-12-10-22(11-13-24)15-20(25)21-18-14-17(2)4-5-19(18)28-3/h4-5,14,16H,6-13,15H2,1-3H3,(H,21,25)
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| InChIKey |
HEEBZUFCUPLHPU-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