8-[(but-2-en-1-yl)oxy]-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(but-2-en-1-yl)oxy]-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-[(but-2-en-1-yl)oxy]-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5339-0388 |
| Compound Name: | 8-[(but-2-en-1-yl)oxy]-7-[(2-fluorophenyl)methyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 358.37 |
| Molecular Formula: | C18 H19 F N4 O3 |
| Smiles: | C/C=C/COc1nc2c(C(N(C)C(N2C)=O)=O)n1Cc1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 3.8505 |
| logD: | 3.8505 |
| logSw: | -3.9243 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.422 |
| InChI Key: | FHKDOCSUWATKEH-UHFFFAOYSA-N |