7-benzyl-2-(2-chlorophenyl)-9-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
7-benzyl-2-(2-chlorophenyl)-9-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
7-benzyl-2-(2-chlorophenyl)-9-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | G656-0513 |
| Compound Name: | 7-benzyl-2-(2-chlorophenyl)-9-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 499.96 |
| Molecular Formula: | C27 H22 Cl N5 O3 |
| Smiles: | CCOc1ccc(cc1)N1C(N(Cc2ccccc2)c2c(C(N)=O)nc(c3ccccc3[Cl])nc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1182 |
| logD: | 5.1182 |
| logSw: | -5.3987 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.93 |
| InChI Key: | KAYPUXIVCLTZCO-UHFFFAOYSA-N |