6-(azepane-1-sulfonyl)-1-ethyl-N-[(2-methoxyphenyl)methyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-1-ethyl-N-[(2-methoxyphenyl)methyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
6-(azepane-1-sulfonyl)-1-ethyl-N-[(2-methoxyphenyl)methyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C519-1639 |
| Compound Name: | 6-(azepane-1-sulfonyl)-1-ethyl-N-[(2-methoxyphenyl)methyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 497.61 |
| Molecular Formula: | C26 H31 N3 O5 S |
| Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CCCCCC1)(=O)=O)=O)C(NCc1ccccc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6043 |
| logD: | 3.6041 |
| logSw: | -3.8727 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.645 |
| InChI Key: | XEYKBVZOTMDFJO-UHFFFAOYSA-N |