6-[cyclohexyl(methyl)sulfamoyl]-N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-1-methyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
6-[cyclohexyl(methyl)sulfamoyl]-N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-1-methyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
6-[cyclohexyl(methyl)sulfamoyl]-N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-1-methyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C519-0717 |
| Compound Name: | 6-[cyclohexyl(methyl)sulfamoyl]-N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-1-methyl-4-oxo-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 597.75 |
| Molecular Formula: | C31 H40 F N5 O4 S |
| Smiles: | CN1C=C(C(c2cc(ccc12)S(N(C)C1CCCCC1)(=O)=O)=O)C(NCCCN1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3999 |
| logD: | 3.0987 |
| logSw: | -4.1447 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.4 |
| InChI Key: | VGOOUSKNDAJPQL-UHFFFAOYSA-N |