2-[3-acetyl-5-({[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}methyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-bromo-6-iodophenyl acetate
Chemical Structure Depiction of
2-[3-acetyl-5-({[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}methyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-bromo-6-iodophenyl acetate
2-[3-acetyl-5-({[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}methyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-bromo-6-iodophenyl acetate
Compound characteristics
| Compound ID: | G642-1927 |
| Compound Name: | 2-[3-acetyl-5-({[5-bromo-3-cyano-4-(methoxymethyl)-6-methylpyridin-2-yl]oxy}methyl)-2,3-dihydro-1,3,4-oxadiazol-2-yl]-4-bromo-6-iodophenyl acetate |
| Molecular Weight: | 722.13 |
| Molecular Formula: | C22 H19 Br2 I N4 O6 |
| Smiles: | CC(N1C(c2cc(cc(c2OC(C)=O)I)[Br])OC(COc2c(C#N)c(COC)c(c(C)n2)[Br])=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7416 |
| logD: | 4.7416 |
| logSw: | -4.7024 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 99.251 |
| InChI Key: | UBPYOHBKHGPSNV-QFIPXVFZSA-N |