N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L078-0477 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-[1-(3,5-dimethylbenzene-1-sulfonyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 500.59 |
| Molecular Formula: | C23 H24 N4 O5 S2 |
| Smiles: | Cc1cc(C)cc(c1)S(N1CCC(CC1)c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0153 |
| logD: | 4.0144 |
| logSw: | -4.0156 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.389 |
| InChI Key: | IPTGOHOWXHDLLS-UHFFFAOYSA-N |