7-[(2-chloro-6-fluorophenyl)methyl]-8-{[2-(diethylamino)ethyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-[(2-chloro-6-fluorophenyl)methyl]-8-{[2-(diethylamino)ethyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
7-[(2-chloro-6-fluorophenyl)methyl]-8-{[2-(diethylamino)ethyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 7282-5425 |
| Compound Name: | 7-[(2-chloro-6-fluorophenyl)methyl]-8-{[2-(diethylamino)ethyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 436.92 |
| Molecular Formula: | C20 H26 Cl F N6 O2 |
| Smiles: | CCN(CC)CCNc1nc2c(C(N(C)C(N2C)=O)=O)n1Cc1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 3.6311 |
| logD: | 0.5561 |
| logSw: | -3.9274 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.37 |
| InChI Key: | UIPHDNQQBAOFIF-UHFFFAOYSA-N |