1-ethyl-3-(3-methoxyphenyl)-7-[2-(4-methylphenyl)-2-oxoethyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-ethyl-3-(3-methoxyphenyl)-7-[2-(4-methylphenyl)-2-oxoethyl]-3,7-dihydro-1H-purine-2,6-dione
1-ethyl-3-(3-methoxyphenyl)-7-[2-(4-methylphenyl)-2-oxoethyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V028-7519 |
| Compound Name: | 1-ethyl-3-(3-methoxyphenyl)-7-[2-(4-methylphenyl)-2-oxoethyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 418.45 |
| Molecular Formula: | C23 H22 N4 O4 |
| Smiles: | CCN1C(c2c(ncn2CC(c2ccc(C)cc2)=O)N(C1=O)c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7666 |
| logD: | 2.7666 |
| logSw: | -2.9835 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 63.062 |
| InChI Key: | HYZFIPMIOVRWFG-UHFFFAOYSA-N |