2-{[4-acetyl-5-(5-bromo-2,4-dimethoxyphenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]methoxy}-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[4-acetyl-5-(5-bromo-2,4-dimethoxyphenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]methoxy}-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
2-{[4-acetyl-5-(5-bromo-2,4-dimethoxyphenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]methoxy}-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
Compound characteristics
| Compound ID: | G642-1620 |
| Compound Name: | 2-{[4-acetyl-5-(5-bromo-2,4-dimethoxyphenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]methoxy}-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile |
| Molecular Weight: | 519.35 |
| Molecular Formula: | C22 H23 Br N4 O6 |
| Smiles: | CC(N1C(c2cc(c(cc2OC)OC)[Br])OC(COc2c(C#N)c(COC)cc(C)n2)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2246 |
| logD: | 3.2246 |
| logSw: | -3.2849 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 92.817 |
| InChI Key: | VTVSOFRGVOYJNY-QFIPXVFZSA-N |