5-[1-(3-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[1-(3-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-[1-(3-methylbenzene-1-sulfonyl)piperidin-4-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L078-0371 |
| Compound Name: | 5-[1-(3-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: | Cc1cccc(c1)S(N1CCC(CC1)c1nnc(C(Nc2ccccc2)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6761 |
| logD: | 3.676 |
| logSw: | -3.8037 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.273 |
| InChI Key: | PPIONQVKCUAJKB-UHFFFAOYSA-N |