5,5-dioxo-N-[3-(piperidin-1-yl)propyl]-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
5,5-dioxo-N-[3-(piperidin-1-yl)propyl]-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
5,5-dioxo-N-[3-(piperidin-1-yl)propyl]-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
Compound ID: | C909-0537 |
Compound Name: | 5,5-dioxo-N-[3-(piperidin-1-yl)propyl]-4,5-dihydro-5lambda~6~-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
Molecular Weight: | 404.55 |
Molecular Formula: | C20 H24 N2 O3 S2 |
Smiles: | C1CCN(CC1)CCCNC(c1cc2CS(c3ccccc3c2s1)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.78 |
logD: | 0.1837 |
logSw: | -3.5244 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 57.669 |
InChI Key: | FABQSCBAYKKGHZ-UHFFFAOYSA-N |