3-(4-fluorophenyl)-7-[(4-nitrophenyl)methyl]-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
3-(4-fluorophenyl)-7-[(4-nitrophenyl)methyl]-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
3-(4-fluorophenyl)-7-[(4-nitrophenyl)methyl]-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | V024-1504 |
| Compound Name: | 3-(4-fluorophenyl)-7-[(4-nitrophenyl)methyl]-1-[(oxolan-2-yl)methyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 465.44 |
| Molecular Formula: | C23 H20 F N5 O5 |
| Salt: | not_available |
| Smiles: | C1CC(CN2C(c3c(ncn3Cc3ccc(cc3)[N+]([O-])=O)N(C2=O)c2ccc(cc2)F)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3484 |
| logD: | 2.3484 |
| logSw: | -2.4766 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 84.31 |
| InChI Key: | PORXECAGBZLUPC-LJQANCHMSA-N |