9-(3,4-dimethylphenyl)-2-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
9-(3,4-dimethylphenyl)-2-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
9-(3,4-dimethylphenyl)-2-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | G656-1117 |
| Compound Name: | 9-(3,4-dimethylphenyl)-2-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C22 H21 N5 O3 |
| Smiles: | [H]N1C(N(c2ccc(C)c(C)c2)c2c1c(C(N)=O)nc(c1ccc(cc1)OCC)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4483 |
| logD: | 4.4409 |
| logSw: | -4.3728 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.734 |
| InChI Key: | OXWBJUUWPUSBCO-UHFFFAOYSA-N |