N-(2H-1,3-benzodioxol-5-yl)-5-[1-(2-phenylbutanoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(2-phenylbutanoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(2-phenylbutanoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L076-0862 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-[1-(2-phenylbutanoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 478.57 |
| Molecular Formula: | C25 H26 N4 O4 S |
| Smiles: | CCC(C(N1CCC(CC1)c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1251 |
| logD: | 4.1242 |
| logSw: | -4.014 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.326 |
| InChI Key: | RNRZSVLPSZTWCY-LJQANCHMSA-N |