1,3-diethyl-8-[2-(2-methoxy-5-phenoxyphenyl)ethenyl]-7-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-diethyl-8-[2-(2-methoxy-5-phenoxyphenyl)ethenyl]-7-methyl-3,7-dihydro-1H-purine-2,6-dione
1,3-diethyl-8-[2-(2-methoxy-5-phenoxyphenyl)ethenyl]-7-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | H025-3282 |
| Compound Name: | 1,3-diethyl-8-[2-(2-methoxy-5-phenoxyphenyl)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/c3cc(ccc3OC)Oc3ccccc3)n2C)N(CC)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8153 |
| logD: | 4.8153 |
| logSw: | -4.7169 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.787 |
| InChI Key: | YZERTMJBNKZJFC-UHFFFAOYSA-N |