9-({4-acetyl-5-[4-(dimethylamino)phenyl]-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-[4-(dimethylamino)phenyl]-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-[4-(dimethylamino)phenyl]-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: | G642-0545 |
| Compound Name: | 9-({4-acetyl-5-[4-(dimethylamino)phenyl]-4,5-dihydro-1,3,4-oxadiazol-2-yl}methyl)-1,3-dimethyl-3,9-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 425.45 |
| Molecular Formula: | C20 H23 N7 O4 |
| Smiles: | CC(N1C(c2ccc(cc2)N(C)C)OC(Cn2cnc3C(N(C)C(N(C)c23)=O)=O)=N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.276 |
| logD: | 1.2673 |
| logSw: | -1.8767 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.139 |
| InChI Key: | QGUMWKXDDREHRX-LJQANCHMSA-N |