N-{5-[(3-bromophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide
Chemical Structure Depiction of
N-{5-[(3-bromophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide
N-{5-[(3-bromophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide
Compound characteristics
| Compound ID: | 3202-0018 |
| Compound Name: | N-{5-[(3-bromophenyl)methyl]-1,3,4-thiadiazol-2-yl}-2-methylpropanamide |
| Molecular Weight: | 340.24 |
| Molecular Formula: | C13 H14 Br N3 O S |
| Smiles: | CC(C)C(Nc1nnc(Cc2cccc(c2)[Br])s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.912 |
| logD: | 3.8881 |
| logSw: | -3.9316 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.37 |
| InChI Key: | UWYNDFHTMWXFRY-UHFFFAOYSA-N |