5-bromo-N-[4-(3,4-dimethylphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
5-bromo-N-[4-(3,4-dimethylphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide
5-bromo-N-[4-(3,4-dimethylphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | D370-0178 |
| Compound Name: | 5-bromo-N-[4-(3,4-dimethylphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 426.27 |
| Molecular Formula: | C20 H16 Br N3 O3 |
| Smiles: | [H]N(C(c1c(C)c2cc(ccc2o1)[Br])=O)c1c(c2ccc(C)c(C)c2)non1 |
| Stereo: | ACHIRAL |
| logP: | 6.5012 |
| logD: | 6.464 |
| logSw: | -5.7123 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.612 |
| InChI Key: | ZGWAIWRFNFDENL-UHFFFAOYSA-N |