N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-3,4,5-trimethoxybenzamide
Chemical Structure Depiction of
N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-3,4,5-trimethoxybenzamide
N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-3,4,5-trimethoxybenzamide
Compound characteristics
| Compound ID: | D323-0037 |
| Compound Name: | N-[3-(4-bromophenyl)-1,2,4-thiadiazol-5-yl]-3,4,5-trimethoxybenzamide |
| Molecular Weight: | 450.31 |
| Molecular Formula: | C18 H16 Br N3 O4 S |
| Smiles: | COc1cc(cc(c1OC)OC)C(Nc1nc(c2ccc(cc2)[Br])ns1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.646 |
| logD: | 4.6458 |
| logSw: | -4.5445 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.895 |
| InChI Key: | HXHJGAJJQIZMKV-UHFFFAOYSA-N |