5-bromo-3-methyl-N-[3-(4-methylphenyl)-1,2,4-thiadiazol-5-yl]-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
5-bromo-3-methyl-N-[3-(4-methylphenyl)-1,2,4-thiadiazol-5-yl]-1-benzofuran-2-carboxamide
5-bromo-3-methyl-N-[3-(4-methylphenyl)-1,2,4-thiadiazol-5-yl]-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | D269-0597 |
| Compound Name: | 5-bromo-3-methyl-N-[3-(4-methylphenyl)-1,2,4-thiadiazol-5-yl]-1-benzofuran-2-carboxamide |
| Molecular Weight: | 428.31 |
| Molecular Formula: | C19 H14 Br N3 O2 S |
| Smiles: | [H]N(C(c1c(C)c2cc(ccc2o1)[Br])=O)c1nc(c2ccc(C)cc2)ns1 |
| Stereo: | ACHIRAL |
| logP: | 6.2974 |
| logD: | 6.2872 |
| logSw: | -5.5427 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.443 |
| InChI Key: | HQXXOBKBFXOKRA-UHFFFAOYSA-N |