2-[(3-acetyl-5-{4-[(4-nitrophenyl)methoxy]phenyl}-2,3-dihydro-1,3,4-oxadiazol-2-yl)methoxy]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-[(3-acetyl-5-{4-[(4-nitrophenyl)methoxy]phenyl}-2,3-dihydro-1,3,4-oxadiazol-2-yl)methoxy]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
2-[(3-acetyl-5-{4-[(4-nitrophenyl)methoxy]phenyl}-2,3-dihydro-1,3,4-oxadiazol-2-yl)methoxy]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
Compound characteristics
| Compound ID: | G642-5800 |
| Compound Name: | 2-[(3-acetyl-5-{4-[(4-nitrophenyl)methoxy]phenyl}-2,3-dihydro-1,3,4-oxadiazol-2-yl)methoxy]-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile |
| Molecular Weight: | 531.52 |
| Molecular Formula: | C27 H25 N5 O7 |
| Smiles: | CC(N1C(COc2c(C#N)c(COC)cc(C)n2)OC(c2ccc(cc2)OCc2ccc(cc2)[N+]([O-])=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0053 |
| logD: | 4.0053 |
| logSw: | -4.431 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 118.214 |
| InChI Key: | LHXVIWMGUUKDRA-RUZDIDTESA-N |