3-(azepane-1-carbonyl)-N-(4-ethoxyphenyl)-4-oxo-1,4-dihydroquinoline-6-sulfonamide
Chemical Structure Depiction of
3-(azepane-1-carbonyl)-N-(4-ethoxyphenyl)-4-oxo-1,4-dihydroquinoline-6-sulfonamide
3-(azepane-1-carbonyl)-N-(4-ethoxyphenyl)-4-oxo-1,4-dihydroquinoline-6-sulfonamide
Compound characteristics
Compound ID: | C385-0406 |
Compound Name: | 3-(azepane-1-carbonyl)-N-(4-ethoxyphenyl)-4-oxo-1,4-dihydroquinoline-6-sulfonamide |
Molecular Weight: | 469.56 |
Molecular Formula: | C24 H27 N3 O5 S |
Smiles: | CCOc1ccc(cc1)NS(c1ccc2c(c1)C(C(=CN2)C(N1CCCCCC1)=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.667 |
logD: | 2.0957 |
logSw: | -3.8331 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 89.11 |
InChI Key: | LWEXJFDLHDDXLL-UHFFFAOYSA-N |