N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-6-(4-methylpiperidine-1-sulfonyl)-2-(pyridin-3-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-6-(4-methylpiperidine-1-sulfonyl)-2-(pyridin-3-yl)quinoline-4-carboxamide
N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-6-(4-methylpiperidine-1-sulfonyl)-2-(pyridin-3-yl)quinoline-4-carboxamide
Compound characteristics
Compound ID: | K788-1743 |
Compound Name: | N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-6-(4-methylpiperidine-1-sulfonyl)-2-(pyridin-3-yl)quinoline-4-carboxamide |
Molecular Weight: | 572.68 |
Molecular Formula: | C31 H32 N4 O5 S |
Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)c(cc(c1cccnc1)n2)C(NC(C)c1ccc2c(c1)OCCO2)=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.4036 |
logD: | 4.4029 |
logSw: | -3.977 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 88.926 |
InChI Key: | HCWLKMRDRUFSER-NRFANRHFSA-N |