1,3-diethyl-8-{2-[3-(4-methoxyphenoxy)phenyl]ethenyl}-7-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-diethyl-8-{2-[3-(4-methoxyphenoxy)phenyl]ethenyl}-7-methyl-3,7-dihydro-1H-purine-2,6-dione
1,3-diethyl-8-{2-[3-(4-methoxyphenoxy)phenyl]ethenyl}-7-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | H025-3287 |
| Compound Name: | 1,3-diethyl-8-{2-[3-(4-methoxyphenoxy)phenyl]ethenyl}-7-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 446.51 |
| Molecular Formula: | C25 H26 N4 O4 |
| Smiles: | CCN1C(c2c(nc(/C=C/c3cccc(c3)Oc3ccc(cc3)OC)n2C)N(CC)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8429 |
| logD: | 4.8429 |
| logSw: | -4.6866 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.7 |
| InChI Key: | XGYHXYXZSHNDPQ-UHFFFAOYSA-N |