N-{4-acetyl-5-[5-bromo-2-(2-phenoxyethoxy)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
Chemical Structure Depiction of
N-{4-acetyl-5-[5-bromo-2-(2-phenoxyethoxy)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
N-{4-acetyl-5-[5-bromo-2-(2-phenoxyethoxy)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
Compound characteristics
| Compound ID: | D336-7269 |
| Compound Name: | N-{4-acetyl-5-[5-bromo-2-(2-phenoxyethoxy)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide |
| Molecular Weight: | 478.36 |
| Molecular Formula: | C20 H20 Br N3 O4 S |
| Smiles: | CC(NC1=NN(C(c2cc(ccc2OCCOc2ccccc2)[Br])S1)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2111 |
| logD: | 4.1646 |
| logSw: | -4.2256 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.793 |
| InChI Key: | RIFSFUODFLJNRU-IBGZPJMESA-N |