7-[(4-fluorophenyl)methyl]-8-{[(4-methoxyphenyl)methyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-fluorophenyl)methyl]-8-{[(4-methoxyphenyl)methyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-[(4-fluorophenyl)methyl]-8-{[(4-methoxyphenyl)methyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | Y600-2662 |
| Compound Name: | 7-[(4-fluorophenyl)methyl]-8-{[(4-methoxyphenyl)methyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 423.45 |
| Molecular Formula: | C22 H22 F N5 O3 |
| Smiles: | CN1C(c2c(nc(NCc3ccc(cc3)OC)n2Cc2ccc(cc2)F)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5761 |
| logD: | 3.5758 |
| logSw: | -3.6478 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.39 |
| InChI Key: | UTDAUGGFYGJCNF-UHFFFAOYSA-N |