6-(azepane-1-sulfonyl)-2-oxo-N-{3-[(propan-2-yl)oxy]propyl}-1,2-dihydroquinoline-4-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-2-oxo-N-{3-[(propan-2-yl)oxy]propyl}-1,2-dihydroquinoline-4-carboxamide
6-(azepane-1-sulfonyl)-2-oxo-N-{3-[(propan-2-yl)oxy]propyl}-1,2-dihydroquinoline-4-carboxamide
Compound characteristics
| Compound ID: | C208-0065 |
| Compound Name: | 6-(azepane-1-sulfonyl)-2-oxo-N-{3-[(propan-2-yl)oxy]propyl}-1,2-dihydroquinoline-4-carboxamide |
| Molecular Weight: | 449.57 |
| Molecular Formula: | C22 H31 N3 O5 S |
| Smiles: | CC(C)OCCCNC(C1=CC(Nc2ccc(cc12)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1707 |
| logD: | 2.1285 |
| logSw: | -3.1143 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.829 |
| InChI Key: | BZHXJGOJGZZQEE-UHFFFAOYSA-N |