9-{[4-acetyl-5-(2-methoxyphenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]methyl}-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
9-{[4-acetyl-5-(2-methoxyphenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]methyl}-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione
9-{[4-acetyl-5-(2-methoxyphenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]methyl}-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | G642-0542 |
| Compound Name: | 9-{[4-acetyl-5-(2-methoxyphenyl)-4,5-dihydro-1,3,4-oxadiazol-2-yl]methyl}-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 412.4 |
| Molecular Formula: | C19 H20 N6 O5 |
| Smiles: | CC(N1C(c2ccccc2OC)OC(Cn2cnc3C(N(C)C(N(C)c23)=O)=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2869 |
| logD: | 1.2868 |
| logSw: | -1.869 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 85.965 |
| InChI Key: | QTWDLTPVPYJDEW-GOSISDBHSA-N |