7-benzyl-3-(2,4-difluorophenyl)-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-benzyl-3-(2,4-difluorophenyl)-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
7-benzyl-3-(2,4-difluorophenyl)-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V016-5143 |
| Compound Name: | 7-benzyl-3-(2,4-difluorophenyl)-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 438.43 |
| Molecular Formula: | C23 H20 F2 N4 O3 |
| Salt: | not_available |
| Smiles: | C1CC(CN2C(c3c(ncn3Cc3ccccc3)N(C2=O)c2ccc(cc2F)F)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4476 |
| logD: | 2.4476 |
| logSw: | -2.7149 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.628 |
| InChI Key: | KUSOILGDDFYWOM-QGZVFWFLSA-N |