7-[(4-fluorophenyl)methyl]-1,3-dimethyl-8-{[(oxolan-2-yl)methyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(4-fluorophenyl)methyl]-1,3-dimethyl-8-{[(oxolan-2-yl)methyl]amino}-3,7-dihydro-1H-purine-2,6-dione
7-[(4-fluorophenyl)methyl]-1,3-dimethyl-8-{[(oxolan-2-yl)methyl]amino}-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 3238-0214 |
| Compound Name: | 7-[(4-fluorophenyl)methyl]-1,3-dimethyl-8-{[(oxolan-2-yl)methyl]amino}-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 387.41 |
| Molecular Formula: | C19 H22 F N5 O3 |
| Smiles: | CN1C(c2c(nc(NCC3CCCO3)n2Cc2ccc(cc2)F)N(C)C1=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4727 |
| logD: | 2.4727 |
| logSw: | -2.7259 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.501 |
| InChI Key: | VWFBEGVPUAKDJS-CQSZACIVSA-N |