7-[(4-fluorophenyl)methyl]-8-(1H-imidazol-1-yl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-fluorophenyl)methyl]-8-(1H-imidazol-1-yl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-[(4-fluorophenyl)methyl]-8-(1H-imidazol-1-yl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 3173-0220 |
| Compound Name: | 7-[(4-fluorophenyl)methyl]-8-(1H-imidazol-1-yl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 354.34 |
| Molecular Formula: | C17 H15 F N6 O2 |
| Smiles: | CN1C(c2c(nc(n3ccnc3)n2Cc2ccc(cc2)F)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0556 |
| logD: | 1.8742 |
| logSw: | -2.2124 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.971 |
| InChI Key: | ONTAKZIDHBWTOQ-UHFFFAOYSA-N |