2-[4-acetyl-5-(pyridin-4-yl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-4-chloro-6-nitrophenyl acetate
Chemical Structure Depiction of
2-[4-acetyl-5-(pyridin-4-yl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-4-chloro-6-nitrophenyl acetate
2-[4-acetyl-5-(pyridin-4-yl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-4-chloro-6-nitrophenyl acetate
Compound characteristics
| Compound ID: | G642-7109 |
| Compound Name: | 2-[4-acetyl-5-(pyridin-4-yl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]-4-chloro-6-nitrophenyl acetate |
| Molecular Weight: | 404.76 |
| Molecular Formula: | C17 H13 Cl N4 O6 |
| Smiles: | CC(N1C(c2ccncc2)OC(c2cc(cc(c2OC(C)=O)[N+]([O-])=O)[Cl])=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0278 |
| logD: | 2.0275 |
| logSw: | -3.0903 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 98.684 |
| InChI Key: | PDDISDBWKMNWCL-QGZVFWFLSA-N |