3-(4-chlorophenyl)-7-[(2-fluorophenyl)methyl]-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-7-[(2-fluorophenyl)methyl]-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
3-(4-chlorophenyl)-7-[(2-fluorophenyl)methyl]-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V016-5083 |
| Compound Name: | 3-(4-chlorophenyl)-7-[(2-fluorophenyl)methyl]-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 454.89 |
| Molecular Formula: | C23 H20 Cl F N4 O3 |
| Salt: | not_available |
| Smiles: | C1CC(CN2C(c3c(ncn3Cc3ccccc3F)N(C2=O)c2ccc(cc2)[Cl])=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2933 |
| logD: | 3.2933 |
| logSw: | -3.5975 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.929 |
| InChI Key: | AKPPHXBEEWPYAX-GOSISDBHSA-N |