8-{2-[4-(benzyloxy)phenyl]ethenyl}-1,3-diethyl-7-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-{2-[4-(benzyloxy)phenyl]ethenyl}-1,3-diethyl-7-methyl-3,7-dihydro-1H-purine-2,6-dione
8-{2-[4-(benzyloxy)phenyl]ethenyl}-1,3-diethyl-7-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | H025-3256 |
| Compound Name: | 8-{2-[4-(benzyloxy)phenyl]ethenyl}-1,3-diethyl-7-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 430.51 |
| Molecular Formula: | C25 H26 N4 O3 |
| Smiles: | CCN1C(c2c(nc(/C=C/c3ccc(cc3)OCc3ccccc3)n2C)N(CC)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5602 |
| logD: | 4.5602 |
| logSw: | -4.6324 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.636 |
| InChI Key: | UORBOSGJHMUVHM-UHFFFAOYSA-N |