N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | Y031-5838 |
| Compound Name: | N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}-1-(thiophene-2-carbonyl)piperidine-4-carboxamide |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C21 H22 N4 O3 S2 |
| Smiles: | COc1ccc(Cc2nnc(NC(C3CCN(CC3)C(c3cccs3)=O)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3305 |
| logD: | 3.2739 |
| logSw: | -3.3706 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.309 |
| InChI Key: | JNNMHTYTKBCQBS-UHFFFAOYSA-N |