6-(azepane-1-sulfonyl)-N-[2-(4-chlorophenyl)ethyl]-1-ethyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-N-[2-(4-chlorophenyl)ethyl]-1-ethyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
6-(azepane-1-sulfonyl)-N-[2-(4-chlorophenyl)ethyl]-1-ethyl-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C519-1623 |
| Compound Name: | 6-(azepane-1-sulfonyl)-N-[2-(4-chlorophenyl)ethyl]-1-ethyl-4-oxo-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 516.06 |
| Molecular Formula: | C26 H30 Cl N3 O4 S |
| Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CCCCCC1)(=O)=O)=O)C(NCCc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9112 |
| logD: | 3.9112 |
| logSw: | -4.4363 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.856 |
| InChI Key: | SMMKXFIQTQPTOU-UHFFFAOYSA-N |