3-(2H-1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)-1,2,4-oxadiazole
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)-1,2,4-oxadiazole
3-(2H-1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)-1,2,4-oxadiazole
Compound characteristics
| Compound ID: | 8017-6981 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-5-(4-nitrophenyl)-1,2,4-oxadiazole |
| Molecular Weight: | 311.25 |
| Molecular Formula: | C15 H9 N3 O5 |
| Smiles: | C1Oc2ccc(cc2O1)c1nc(c2ccc(cc2)[N+]([O-])=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.0582 |
| logD: | 4.0582 |
| logSw: | -4.3923 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.141 |
| InChI Key: | GESBNQWSXIKIIJ-UHFFFAOYSA-N |