8-{[benzyl(methyl)amino]methyl}-7-(2-ethoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-{[benzyl(methyl)amino]methyl}-7-(2-ethoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-{[benzyl(methyl)amino]methyl}-7-(2-ethoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C470-0572 |
| Compound Name: | 8-{[benzyl(methyl)amino]methyl}-7-(2-ethoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 385.46 |
| Molecular Formula: | C20 H27 N5 O3 |
| Smiles: | CCOCCn1c2C(N(C)C(N(C)c2nc1CN(C)Cc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.285 |
| logD: | 2.2802 |
| logSw: | -2.4403 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.752 |
| InChI Key: | PJMHHGPHAOJTNL-UHFFFAOYSA-N |