N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(furan-2-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(furan-2-carbonyl)piperidine-4-carboxamide
N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(furan-2-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | Y031-4521 |
| Compound Name: | N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(furan-2-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C21 H22 N4 O3 S2 |
| Smiles: | C1CN(CCC1C(Nc1nnc(CSCc2ccccc2)s1)=O)C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1068 |
| logD: | 2.8915 |
| logSw: | -3.1699 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.325 |
| InChI Key: | GSGOXNALINDEPQ-UHFFFAOYSA-N |