N-(2H-1,3-benzodioxol-5-yl)-5-[1-(4-ethylbenzene-1-sulfonyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(4-ethylbenzene-1-sulfonyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(4-ethylbenzene-1-sulfonyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L066-0501 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-[1-(4-ethylbenzene-1-sulfonyl)piperidin-3-yl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 500.59 |
| Molecular Formula: | C23 H24 N4 O5 S2 |
| Smiles: | CCc1ccc(cc1)S(N1CCCC(C1)c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0691 |
| logD: | 4.0682 |
| logSw: | -3.9299 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 95.322 |
| InChI Key: | KSMYNTTUJURUJM-INIZCTEOSA-N |