N-(2H-1,3-benzodioxol-5-yl)-5-[1-(4-tert-butylbenzoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(4-tert-butylbenzoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-[1-(4-tert-butylbenzoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L076-0838 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-[1-(4-tert-butylbenzoyl)piperidin-4-yl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 492.6 |
| Molecular Formula: | C26 H28 N4 O4 S |
| Smiles: | CC(C)(C)c1ccc(cc1)C(N1CCC(CC1)c1nnc(C(Nc2ccc3c(c2)OCO3)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7417 |
| logD: | 4.7408 |
| logSw: | -4.4705 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.326 |
| InChI Key: | CJMSBWSCOOMOJY-UHFFFAOYSA-N |