3-methyl-8-{[3-(morpholin-4-yl)propyl]amino}-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-methyl-8-{[3-(morpholin-4-yl)propyl]amino}-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
3-methyl-8-{[3-(morpholin-4-yl)propyl]amino}-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5228-0337 |
| Compound Name: | 3-methyl-8-{[3-(morpholin-4-yl)propyl]amino}-7-(3-phenylpropyl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 426.52 |
| Molecular Formula: | C22 H30 N6 O3 |
| Smiles: | CN1C(NC(c2c1nc(NCCCN1CCOCC1)n2CCCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2705 |
| logD: | 2.0467 |
| logSw: | -2.8715 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.471 |
| InChI Key: | XIRBATSNFNDZKW-UHFFFAOYSA-N |