2-{4-acetyl-5-[3-(acetyloxy)naphthalen-2-yl]-4,5-dihydro-1,3,4-oxadiazol-2-yl}-4-nitrophenyl acetate
Chemical Structure Depiction of
2-{4-acetyl-5-[3-(acetyloxy)naphthalen-2-yl]-4,5-dihydro-1,3,4-oxadiazol-2-yl}-4-nitrophenyl acetate
2-{4-acetyl-5-[3-(acetyloxy)naphthalen-2-yl]-4,5-dihydro-1,3,4-oxadiazol-2-yl}-4-nitrophenyl acetate
Compound characteristics
| Compound ID: | G642-5719 |
| Compound Name: | 2-{4-acetyl-5-[3-(acetyloxy)naphthalen-2-yl]-4,5-dihydro-1,3,4-oxadiazol-2-yl}-4-nitrophenyl acetate |
| Molecular Weight: | 477.43 |
| Molecular Formula: | C24 H19 N3 O8 |
| Smiles: | CC(N1C(c2cc3ccccc3cc2OC(C)=O)OC(c2cc(ccc2OC(C)=O)[N+]([O-])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4619 |
| logD: | 3.4619 |
| logSw: | -3.9599 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 110.037 |
| InChI Key: | QRDWGSFTQSGDCB-XMMPIXPASA-N |