N-[3-(4-benzylpiperazin-1-yl)propyl]-6-(diethylsulfamoyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperazin-1-yl)propyl]-6-(diethylsulfamoyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
N-[3-(4-benzylpiperazin-1-yl)propyl]-6-(diethylsulfamoyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | K786-0073 |
| Compound Name: | N-[3-(4-benzylpiperazin-1-yl)propyl]-6-(diethylsulfamoyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 539.7 |
| Molecular Formula: | C28 H37 N5 O4 S |
| Smiles: | CCN(CC)S(c1ccc2c(c1)C(C(=CN2)C(NCCCN1CCN(CC1)Cc1ccccc1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0124 |
| logD: | 2.0124 |
| logSw: | -3.0765 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.232 |
| InChI Key: | XXJPNHXPWBBMMR-UHFFFAOYSA-N |