N-(3-chlorophenyl)-5-[1-(ethanesulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-[1-(ethanesulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-[1-(ethanesulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | L078-0281 |
Compound Name: | N-(3-chlorophenyl)-5-[1-(ethanesulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 414.93 |
Molecular Formula: | C16 H19 Cl N4 O3 S2 |
Smiles: | CCS(N1CCC(CC1)c1nnc(C(Nc2cccc(c2)[Cl])=O)s1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.8315 |
logD: | 2.8283 |
logSw: | -3.5606 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.439 |
InChI Key: | VKZJRXWRNIYLSY-UHFFFAOYSA-N |