4-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazol-2-yl}-N-[(oxolan-2-yl)methyl]piperidine-1-carboxamide
Chemical Structure Depiction of
4-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazol-2-yl}-N-[(oxolan-2-yl)methyl]piperidine-1-carboxamide
4-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazol-2-yl}-N-[(oxolan-2-yl)methyl]piperidine-1-carboxamide
Compound characteristics
| Compound ID: | L077-0738 |
| Compound Name: | 4-{5-[(2H-1,3-benzodioxol-5-yl)carbamoyl]-1,3,4-thiadiazol-2-yl}-N-[(oxolan-2-yl)methyl]piperidine-1-carboxamide |
| Molecular Weight: | 459.52 |
| Molecular Formula: | C21 H25 N5 O5 S |
| Smiles: | C1CC(CNC(N2CCC(CC2)c2nnc(C(Nc3ccc4c(c3)OCO4)=O)s2)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6797 |
| logD: | 1.6789 |
| logSw: | -2.5578 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.123 |
| InChI Key: | CCXUCQWGOODXBE-OAHLLOKOSA-N |