5-[1-(4-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[1-(4-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-[1-(4-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | L078-0318 |
Compound Name: | 5-[1-(4-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 442.56 |
Molecular Formula: | C21 H22 N4 O3 S2 |
Smiles: | Cc1ccc(cc1)S(N1CCC(CC1)c1nnc(C(Nc2ccccc2)=O)s1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6746 |
logD: | 3.6746 |
logSw: | -3.7522 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.273 |
InChI Key: | LYRQWDGHUHSJLU-UHFFFAOYSA-N |