8-{[(furan-2-yl)methyl]amino}-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-{[(furan-2-yl)methyl]amino}-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
8-{[(furan-2-yl)methyl]amino}-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 7706-0348 |
| Compound Name: | 8-{[(furan-2-yl)methyl]amino}-7-(2-hydroxy-3-phenoxypropyl)-3-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 411.42 |
| Molecular Formula: | C20 H21 N5 O5 |
| Smiles: | CN1C(NC(c2c1nc(NCc1ccco1)n2CC(COc1ccccc1)O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.642 |
| logD: | 2.6418 |
| logSw: | -3.0489 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.628 |
| InChI Key: | ZEPSQYZKEQHMCH-ZDUSSCGKSA-N |