4-[4-acetyl-5-(2-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-2,6-dibromophenyl acetate
Chemical Structure Depiction of
4-[4-acetyl-5-(2-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-2,6-dibromophenyl acetate
4-[4-acetyl-5-(2-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-2,6-dibromophenyl acetate
Compound characteristics
| Compound ID: | G642-6413 |
| Compound Name: | 4-[4-acetyl-5-(2-nitrophenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-2,6-dibromophenyl acetate |
| Molecular Weight: | 527.12 |
| Molecular Formula: | C18 H13 Br2 N3 O6 |
| Smiles: | CC(N1C(c2ccccc2[N+]([O-])=O)OC(c2cc(c(c(c2)[Br])OC(C)=O)[Br])=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3337 |
| logD: | 4.3337 |
| logSw: | -4.5066 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 89.256 |
| InChI Key: | CVTBYZXJLOEQFJ-GOSISDBHSA-N |