N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(furan-2-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(furan-2-carbonyl)piperidine-4-carboxamide
N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(furan-2-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | Y031-4468 |
| Compound Name: | N-{5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(furan-2-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C22 H24 N4 O5 S |
| Smiles: | COc1ccc(Cc2nnc(NC(C3CCN(CC3)C(c3ccco3)=O)=O)s2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.2472 |
| logD: | 2.1905 |
| logSw: | -2.9727 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.586 |
| InChI Key: | MFCSHAAKGJKAPX-UHFFFAOYSA-N |