9-(4-fluorophenyl)-8-oxo-2-[4-(trifluoromethyl)phenyl]-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
9-(4-fluorophenyl)-8-oxo-2-[4-(trifluoromethyl)phenyl]-8,9-dihydro-7H-purine-6-carboxamide
9-(4-fluorophenyl)-8-oxo-2-[4-(trifluoromethyl)phenyl]-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | G656-0805 |
| Compound Name: | 9-(4-fluorophenyl)-8-oxo-2-[4-(trifluoromethyl)phenyl]-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 417.32 |
| Molecular Formula: | C19 H11 F4 N5 O2 |
| Smiles: | [H]N1C(N(c2ccc(cc2)F)c2c1c(C(N)=O)nc(c1ccc(cc1)C(F)(F)F)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8486 |
| logD: | 3.811 |
| logSw: | -4.4068 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.61 |
| InChI Key: | SPTPZPWKDWQMGF-UHFFFAOYSA-N |