N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide
Chemical Structure Depiction of
N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide
N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide
Compound characteristics
| Compound ID: | V016-8817 |
| Compound Name: | N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide |
| Molecular Weight: | 355.48 |
| Molecular Formula: | C18 H17 N3 O S2 |
| Smiles: | C(Cc1ccccc1)C(Nc1nnc(SCc2ccccc2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4884 |
| logD: | 4.4825 |
| logSw: | -4.4623 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.751 |
| InChI Key: | CIMJWMUHPZQYDF-UHFFFAOYSA-N |