1-ethyl-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-6-(4-methylpiperidine-1-sulfonyl)quinolin-4(1H)-one
Chemical Structure Depiction of
1-ethyl-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-6-(4-methylpiperidine-1-sulfonyl)quinolin-4(1H)-one
1-ethyl-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-6-(4-methylpiperidine-1-sulfonyl)quinolin-4(1H)-one
Compound characteristics
Compound ID: | C519-1797 |
Compound Name: | 1-ethyl-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-6-(4-methylpiperidine-1-sulfonyl)quinolin-4(1H)-one |
Molecular Weight: | 552.69 |
Molecular Formula: | C29 H36 N4 O5 S |
Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CCC(C)CC1)(=O)=O)=O)C(N1CCN(CC1)c1ccccc1OC)=O |
Stereo: | ACHIRAL |
logP: | 3.401 |
logD: | 3.401 |
logSw: | -3.9903 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 74.508 |
InChI Key: | XXFPSBAVTFSVIP-UHFFFAOYSA-N |