6-(azepane-1-sulfonyl)-1-methyl-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-1-methyl-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-1,4-dihydroquinoline-3-carboxamide
6-(azepane-1-sulfonyl)-1-methyl-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C519-0593 |
| Compound Name: | 6-(azepane-1-sulfonyl)-1-methyl-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 463.6 |
| Molecular Formula: | C23 H33 N3 O5 S |
| Smiles: | CC(C)OCCCNC(C1=CN(C)c2ccc(cc2C1=O)S(N1CCCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9228 |
| logD: | 1.9228 |
| logSw: | -3.0197 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.319 |
| InChI Key: | CYXGVCQMOVDPCI-UHFFFAOYSA-N |