1-benzyl-8-{[(furan-2-yl)methyl]amino}-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-benzyl-8-{[(furan-2-yl)methyl]amino}-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
1-benzyl-8-{[(furan-2-yl)methyl]amino}-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 5339-0454 |
| Compound Name: | 1-benzyl-8-{[(furan-2-yl)methyl]amino}-3,7-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 365.39 |
| Molecular Formula: | C19 H19 N5 O3 |
| Smiles: | CN1C(N(Cc2ccccc2)C(c2c1nc(NCc1ccco1)n2C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8592 |
| logD: | 2.8574 |
| logSw: | -3.196 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.639 |
| InChI Key: | DAGVAGHCNGPQBR-UHFFFAOYSA-N |