N-(4-acetyl-5-{5-bromo-2-[(4-methylphenyl)methoxy]phenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
N-(4-acetyl-5-{5-bromo-2-[(4-methylphenyl)methoxy]phenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
N-(4-acetyl-5-{5-bromo-2-[(4-methylphenyl)methoxy]phenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | D336-7422 |
| Compound Name: | N-(4-acetyl-5-{5-bromo-2-[(4-methylphenyl)methoxy]phenyl}-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 462.36 |
| Molecular Formula: | C20 H20 Br N3 O3 S |
| Smiles: | CC(NC1=NN(C(c2cc(ccc2OCc2ccc(C)cc2)[Br])S1)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6762 |
| logD: | 4.6298 |
| logSw: | -4.6735 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.457 |
| InChI Key: | VXWXXSLKFKLYHK-IBGZPJMESA-N |