6-(azepane-1-sulfonyl)-N-{2-[butyl(methyl)amino]ethyl}-2-oxo-1,2-dihydroquinoline-4-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-N-{2-[butyl(methyl)amino]ethyl}-2-oxo-1,2-dihydroquinoline-4-carboxamide
6-(azepane-1-sulfonyl)-N-{2-[butyl(methyl)amino]ethyl}-2-oxo-1,2-dihydroquinoline-4-carboxamide
Compound characteristics
| Compound ID: | K786-1138 |
| Compound Name: | 6-(azepane-1-sulfonyl)-N-{2-[butyl(methyl)amino]ethyl}-2-oxo-1,2-dihydroquinoline-4-carboxamide |
| Molecular Weight: | 462.61 |
| Molecular Formula: | C23 H34 N4 O4 S |
| Smiles: | CCCCN(C)CCNC(C1=CC(Nc2ccc(cc12)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5121 |
| logD: | 0.6557 |
| logSw: | -3.1509 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.7 |
| InChI Key: | MPUOVPIVOHLGLO-UHFFFAOYSA-N |