N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-methoxybenzoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-methoxybenzoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-methoxybenzoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | L076-0834 |
Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3-methoxybenzoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 466.51 |
Molecular Formula: | C23 H22 N4 O5 S |
Smiles: | COc1cccc(c1)C(N1CCC(CC1)c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)=O |
Stereo: | ACHIRAL |
logP: | 2.9253 |
logD: | 2.9244 |
logSw: | -3.4437 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.87 |
InChI Key: | HOUMTCJVSWZANG-UHFFFAOYSA-N |