N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide
N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8582-1604 |
| Compound Name: | N-[5-(benzylsulfanyl)-1,3,4-thiadiazol-2-yl]-3,4-dihydro-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 383.49 |
| Molecular Formula: | C19 H17 N3 O2 S2 |
| Smiles: | C1C(COc2ccccc12)C(Nc1nnc(SCc2ccccc2)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4882 |
| logD: | 4.4621 |
| logSw: | -4.4604 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.334 |
| InChI Key: | SBEHZPGVSYIKBM-HNNXBMFYSA-N |