N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,5-dimethoxybenzamide
N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | V013-4007 |
| Compound Name: | N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,5-dimethoxybenzamide |
| Molecular Weight: | 387.48 |
| Molecular Formula: | C18 H17 N3 O3 S2 |
| Salt: | not_available |
| Smiles: | COc1cc(cc(c1)OC)C(Nc1nnc(SCc2ccccc2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4775 |
| logD: | 4.4746 |
| logSw: | -4.3343 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.052 |
| InChI Key: | QAAAVNHYCMESCS-UHFFFAOYSA-N |