8-(4-fluorophenoxy)-1,3-dimethyl-9-(propan-2-yl)-3,9-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-(4-fluorophenoxy)-1,3-dimethyl-9-(propan-2-yl)-3,9-dihydro-1H-purine-2,6-dione
8-(4-fluorophenoxy)-1,3-dimethyl-9-(propan-2-yl)-3,9-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8012-5925 |
| Compound Name: | 8-(4-fluorophenoxy)-1,3-dimethyl-9-(propan-2-yl)-3,9-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 332.33 |
| Molecular Formula: | C16 H17 F N4 O3 |
| Smiles: | CC(C)n1c2c(C(N(C)C(N2C)=O)=O)nc1Oc1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 3.1619 |
| logD: | 3.1619 |
| logSw: | -3.4414 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.043 |
| InChI Key: | JEOZYCPFSRQUMD-UHFFFAOYSA-N |