N-{4-acetyl-5-[3-bromo-4-(dimethylamino)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
Chemical Structure Depiction of
N-{4-acetyl-5-[3-bromo-4-(dimethylamino)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
N-{4-acetyl-5-[3-bromo-4-(dimethylamino)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide
Compound characteristics
| Compound ID: | D336-6780 |
| Compound Name: | N-{4-acetyl-5-[3-bromo-4-(dimethylamino)phenyl]-4,5-dihydro-1,3,4-thiadiazol-2-yl}acetamide |
| Molecular Weight: | 385.28 |
| Molecular Formula: | C14 H17 Br N4 O2 S |
| Smiles: | CC(NC1=NN(C(c2ccc(c(c2)[Br])N(C)C)S1)C(C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4928 |
| logD: | 2.4463 |
| logSw: | -2.9378 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.646 |
| InChI Key: | BYHHOFCXSJRWJV-ZDUSSCGKSA-N |