N-[4-(4-bromophenyl)-1,2,5-oxadiazol-3-yl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Chemical Structure Depiction of
N-[4-(4-bromophenyl)-1,2,5-oxadiazol-3-yl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide
N-[4-(4-bromophenyl)-1,2,5-oxadiazol-3-yl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Compound characteristics
| Compound ID: | D370-0072 |
| Compound Name: | N-[4-(4-bromophenyl)-1,2,5-oxadiazol-3-yl]-2,3-dihydro-1,4-benzodioxine-2-carboxamide |
| Molecular Weight: | 402.2 |
| Molecular Formula: | C17 H12 Br N3 O4 |
| Smiles: | [H]N(C(C1COc2ccccc2O1)=O)c1c(c2ccc(cc2)[Br])non1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4377 |
| logD: | 4.4154 |
| logSw: | -4.5872 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.523 |
| InChI Key: | FJNVWZLUGAYOOS-AWEZNQCLSA-N |