2-(3-bromo-4-methoxyphenyl)-9-(4-fluorophenyl)-7-methyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
2-(3-bromo-4-methoxyphenyl)-9-(4-fluorophenyl)-7-methyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
2-(3-bromo-4-methoxyphenyl)-9-(4-fluorophenyl)-7-methyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | G656-0975 |
| Compound Name: | 2-(3-bromo-4-methoxyphenyl)-9-(4-fluorophenyl)-7-methyl-8-oxo-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 472.27 |
| Molecular Formula: | C20 H15 Br F N5 O3 |
| Smiles: | CN1C(N(c2ccc(cc2)F)c2c1c(C(N)=O)nc(c1ccc(c(c1)[Br])OC)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9836 |
| logD: | 3.9836 |
| logSw: | -4.4424 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.474 |
| InChI Key: | CGDXJNJBQBWREK-UHFFFAOYSA-N |