1-{5-[2-(benzyloxy)-5-bromophenyl]-2-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
Chemical Structure Depiction of
1-{5-[2-(benzyloxy)-5-bromophenyl]-2-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
1-{5-[2-(benzyloxy)-5-bromophenyl]-2-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | F076-2128 |
| Compound Name: | 1-{5-[2-(benzyloxy)-5-bromophenyl]-2-(4-nitrophenyl)-1,3,4-oxadiazol-3(2H)-yl}ethan-1-one |
| Molecular Weight: | 496.32 |
| Molecular Formula: | C23 H18 Br N3 O5 |
| Smiles: | CC(N1C(c2ccc(cc2)[N+]([O-])=O)OC(c2cc(ccc2OCc2ccccc2)[Br])=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5092 |
| logD: | 5.5092 |
| logSw: | -5.5569 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.947 |
| InChI Key: | RHVYECLAELLCGD-HSZRJFAPSA-N |