N-cyclopentyl-1-ethyl-6-(4-methylpiperidine-1-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-1-ethyl-6-(4-methylpiperidine-1-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
N-cyclopentyl-1-ethyl-6-(4-methylpiperidine-1-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
Compound ID: | C519-1835 |
Compound Name: | N-cyclopentyl-1-ethyl-6-(4-methylpiperidine-1-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide |
Molecular Weight: | 445.58 |
Molecular Formula: | C23 H31 N3 O4 S |
Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CCC(C)CC1)(=O)=O)=O)C(NC1CCCC1)=O |
Stereo: | ACHIRAL |
logP: | 3.5187 |
logD: | 3.5187 |
logSw: | -3.9927 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.774 |
InChI Key: | BAHDEVJPCZWUSS-UHFFFAOYSA-N |