N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-3-ethoxybenzamide
Chemical Structure Depiction of
N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-3-ethoxybenzamide
N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-3-ethoxybenzamide
Compound characteristics
| Compound ID: | 3086-0052 |
| Compound Name: | N-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-3-ethoxybenzamide |
| Molecular Weight: | 385.51 |
| Molecular Formula: | C19 H19 N3 O2 S2 |
| Smiles: | CCOc1cccc(c1)C(Nc1nnc(CSCc2ccccc2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6643 |
| logD: | 4.3297 |
| logSw: | -4.3688 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.222 |
| InChI Key: | KPJQGDXQDWYADJ-UHFFFAOYSA-N |