6-(azepane-1-sulfonyl)-1-methyl-4-oxo-N-[(pyridin-3-yl)methyl]-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-1-methyl-4-oxo-N-[(pyridin-3-yl)methyl]-1,4-dihydroquinoline-3-carboxamide
6-(azepane-1-sulfonyl)-1-methyl-4-oxo-N-[(pyridin-3-yl)methyl]-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C519-0564 |
| Compound Name: | 6-(azepane-1-sulfonyl)-1-methyl-4-oxo-N-[(pyridin-3-yl)methyl]-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 454.55 |
| Molecular Formula: | C23 H26 N4 O4 S |
| Smiles: | CN1C=C(C(c2cc(ccc12)S(N1CCCCCC1)(=O)=O)=O)C(NCc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5287 |
| logD: | 1.5286 |
| logSw: | -2.2502 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.522 |
| InChI Key: | YCAXFQRRNXVLIP-UHFFFAOYSA-N |