7-(2-ethoxyethyl)-8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-(2-ethoxyethyl)-8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-(2-ethoxyethyl)-8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0592 |
| Compound Name: | 7-(2-ethoxyethyl)-8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C23 H32 N6 O4 |
| Smiles: | CCOCCn1c2C(N(C)C(N(C)c2nc1CN1CCN(CC1)c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3093 |
| logD: | 2.3088 |
| logSw: | -2.5321 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.445 |
| InChI Key: | ATUGXWMEMPOAIU-UHFFFAOYSA-N |