7-ethyl-3-(4-methoxyphenyl)-1-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-ethyl-3-(4-methoxyphenyl)-1-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
7-ethyl-3-(4-methoxyphenyl)-1-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-0538 |
| Compound Name: | 7-ethyl-3-(4-methoxyphenyl)-1-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 342.4 |
| Molecular Formula: | C18 H22 N4 O3 |
| Smiles: | CCn1cnc2c1C(N(CC(C)C)C(N2c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3907 |
| logD: | 2.3907 |
| logSw: | -2.4729 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.086 |
| InChI Key: | UOAZUTJSAWLRLV-UHFFFAOYSA-N |