7-benzyl-2-(3,4-dimethoxyphenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
7-benzyl-2-(3,4-dimethoxyphenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
7-benzyl-2-(3,4-dimethoxyphenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | G656-0788 |
| Compound Name: | 7-benzyl-2-(3,4-dimethoxyphenyl)-9-(4-fluorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 499.5 |
| Molecular Formula: | C27 H22 F N5 O4 |
| Smiles: | COc1ccc(cc1OC)c1nc(C(N)=O)c2c(n1)N(C(N2Cc1ccccc1)=O)c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 4.8097 |
| logD: | 4.8097 |
| logSw: | -4.8829 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.067 |
| InChI Key: | PDBHVSMWSTUDHB-UHFFFAOYSA-N |