2-{4-acetyl-5-[2-(benzyloxy)-5-bromophenyl]-4,5-dihydro-1,3,4-oxadiazol-2-yl}-4-nitrophenyl acetate
Chemical Structure Depiction of
2-{4-acetyl-5-[2-(benzyloxy)-5-bromophenyl]-4,5-dihydro-1,3,4-oxadiazol-2-yl}-4-nitrophenyl acetate
2-{4-acetyl-5-[2-(benzyloxy)-5-bromophenyl]-4,5-dihydro-1,3,4-oxadiazol-2-yl}-4-nitrophenyl acetate
Compound characteristics
| Compound ID: | G642-7772 |
| Compound Name: | 2-{4-acetyl-5-[2-(benzyloxy)-5-bromophenyl]-4,5-dihydro-1,3,4-oxadiazol-2-yl}-4-nitrophenyl acetate |
| Molecular Weight: | 554.35 |
| Molecular Formula: | C25 H20 Br N3 O7 |
| Smiles: | CC(N1C(c2cc(ccc2OCc2ccccc2)[Br])OC(c2cc(ccc2OC(C)=O)[N+]([O-])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1761 |
| logD: | 5.1761 |
| logSw: | -5.1782 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 96.785 |
| InChI Key: | VMBVSOGQHBHLNV-VWLOTQADSA-N |