General Information of the Compound
| Compound ID |
CP0498513
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| Compound Name |
N-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-5-methoxy-2-(propan-2-ylcarbamoylamino)benzamide
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| Structure |
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| Formula |
C24H31ClN4O3
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| Molecular Weight |
458.99
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| Canonical SMILES |
COc1ccc(NC(=O)NC(C)C)c(c1)C(=O)NC1CCN(Cc2ccc(Cl)cc2)CC1
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| InChI |
InChI=1S/C24H31ClN4O3/c1-16(2)26-24(31)28-22-9-8-20(32-3)14-21(22)23(30)27-19-10-12-29(13-11-19)15-17-4-6-18(25)7-5-17/h4-9,14,16,19H,10-13,15H2,1-3H3,(H,27,30)(H2,26,28,31)
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| InChIKey |
YORQKKJBGIZEOX-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