3-(2,4-difluorophenyl)-1-[(oxolan-2-yl)methyl]-7-{[4-(trifluoromethyl)phenyl]methyl}-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(2,4-difluorophenyl)-1-[(oxolan-2-yl)methyl]-7-{[4-(trifluoromethyl)phenyl]methyl}-3,7-dihydro-1H-purine-2,6-dione
3-(2,4-difluorophenyl)-1-[(oxolan-2-yl)methyl]-7-{[4-(trifluoromethyl)phenyl]methyl}-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V023-5671 |
| Compound Name: | 3-(2,4-difluorophenyl)-1-[(oxolan-2-yl)methyl]-7-{[4-(trifluoromethyl)phenyl]methyl}-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 506.43 |
| Molecular Formula: | C24 H19 F5 N4 O3 |
| Salt: | not_available |
| Smiles: | C1CC(CN2C(c3c(ncn3Cc3ccc(cc3)C(F)(F)F)N(C2=O)c2ccc(cc2F)F)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3203 |
| logD: | 3.3203 |
| logSw: | -3.5984 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.628 |
| InChI Key: | VPKUKKVOJXRDCP-QGZVFWFLSA-N |