2-[(4-acetyl-5-phenyl-4,5-dihydro-1,3,4-oxadiazol-2-yl)methoxy]-5-bromo-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
Chemical Structure Depiction of
2-[(4-acetyl-5-phenyl-4,5-dihydro-1,3,4-oxadiazol-2-yl)methoxy]-5-bromo-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
2-[(4-acetyl-5-phenyl-4,5-dihydro-1,3,4-oxadiazol-2-yl)methoxy]-5-bromo-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile
Compound characteristics
Compound ID: | G642-1904 |
Compound Name: | 2-[(4-acetyl-5-phenyl-4,5-dihydro-1,3,4-oxadiazol-2-yl)methoxy]-5-bromo-4-(methoxymethyl)-6-methylpyridine-3-carbonitrile |
Molecular Weight: | 459.3 |
Molecular Formula: | C20 H19 Br N4 O4 |
Smiles: | CC(N1C(c2ccccc2)OC(COc2c(C#N)c(COC)c(c(C)n2)[Br])=N1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.394 |
logD: | 3.394 |
logSw: | -3.7467 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 78.327 |
InChI Key: | QYLRYPRQBKCTOE-FQEVSTJZSA-N |