6-(azepane-1-sulfonyl)-N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-2-oxo-1,2-dihydroquinoline-4-carboxamide
Chemical Structure Depiction of
6-(azepane-1-sulfonyl)-N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-2-oxo-1,2-dihydroquinoline-4-carboxamide
6-(azepane-1-sulfonyl)-N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-2-oxo-1,2-dihydroquinoline-4-carboxamide
Compound characteristics
Compound ID: | K786-4248 |
Compound Name: | 6-(azepane-1-sulfonyl)-N-{3-[4-(2-fluorophenyl)piperazin-1-yl]propyl}-2-oxo-1,2-dihydroquinoline-4-carboxamide |
Molecular Weight: | 569.7 |
Molecular Formula: | C29 H36 F N5 O4 S |
Smiles: | C1CCCN(CC1)S(c1ccc2c(c1)C(=CC(N2)=O)C(NCCCN1CCN(CC1)c1ccccc1F)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.1089 |
logD: | 2.8077 |
logSw: | -3.7167 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 88.298 |
InChI Key: | MHLUHSBVNBZHSQ-UHFFFAOYSA-N |