8-{[(furan-2-yl)methyl]amino}-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-{[(furan-2-yl)methyl]amino}-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
8-{[(furan-2-yl)methyl]amino}-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 4236-1022 |
| Compound Name: | 8-{[(furan-2-yl)methyl]amino}-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 425.44 |
| Molecular Formula: | C21 H23 N5 O5 |
| Smiles: | Cc1ccccc1OCC(Cn1c2C(NC(N(C)c2nc1NCc1ccco1)=O)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2696 |
| logD: | 3.2694 |
| logSw: | -3.4298 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.714 |
| InChI Key: | FETCBGZRWUBUOL-AWEZNQCLSA-N |