2-(5-bromo-2-hydroxyphenyl)-9-(4-chlorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
2-(5-bromo-2-hydroxyphenyl)-9-(4-chlorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
2-(5-bromo-2-hydroxyphenyl)-9-(4-chlorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | C926-0289 |
| Compound Name: | 2-(5-bromo-2-hydroxyphenyl)-9-(4-chlorophenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 460.67 |
| Molecular Formula: | C18 H11 Br Cl N5 O3 |
| Smiles: | c1cc(ccc1N1C(Nc2c(C(N)=O)nc(c3cc(ccc3O)[Br])nc12)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.7973 |
| logD: | 3.7597 |
| logSw: | -4.0902 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 95.159 |
| InChI Key: | IRXOWNGFFYPLLK-UHFFFAOYSA-N |