5-bromo-N-[4-(4-ethoxy-3-methylphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
5-bromo-N-[4-(4-ethoxy-3-methylphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide
5-bromo-N-[4-(4-ethoxy-3-methylphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | D370-0489 |
| Compound Name: | 5-bromo-N-[4-(4-ethoxy-3-methylphenyl)-1,2,5-oxadiazol-3-yl]-3-methyl-1-benzofuran-2-carboxamide |
| Molecular Weight: | 456.29 |
| Molecular Formula: | C21 H18 Br N3 O4 |
| Smiles: | [H]N(C(c1c(C)c2cc(ccc2o1)[Br])=O)c1c(c2ccc(c(C)c2)OCC)non1 |
| Stereo: | ACHIRAL |
| logP: | 6.3737 |
| logD: | 6.3366 |
| logSw: | -5.6475 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.822 |
| InChI Key: | MHADUHUJQFMBDV-UHFFFAOYSA-N |