8-bromo-7-[2-(4-fluorophenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-bromo-7-[2-(4-fluorophenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
8-bromo-7-[2-(4-fluorophenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8015-9154 |
| Compound Name: | 8-bromo-7-[2-(4-fluorophenyl)-2-oxoethyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 395.19 |
| Molecular Formula: | C15 H12 Br F N4 O3 |
| Smiles: | CN1C(c2c(nc(n2CC(c2ccc(cc2)F)=O)[Br])N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2717 |
| logD: | 2.2717 |
| logSw: | -2.5755 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.551 |
| InChI Key: | NRJXYTRLRXVHCC-UHFFFAOYSA-N |