7-benzyl-9-(3,4-dimethylphenyl)-2-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
7-benzyl-9-(3,4-dimethylphenyl)-2-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
7-benzyl-9-(3,4-dimethylphenyl)-2-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | G656-1064 |
| Compound Name: | 7-benzyl-9-(3,4-dimethylphenyl)-2-(4-ethoxyphenyl)-8-oxo-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 493.57 |
| Molecular Formula: | C29 H27 N5 O3 |
| Smiles: | CCOc1ccc(cc1)c1nc(C(N)=O)c2c(n1)N(C(N2Cc1ccccc1)=O)c1ccc(C)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.6596 |
| logD: | 6.6596 |
| logSw: | -5.6181 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.93 |
| InChI Key: | HSNQCCDGELGHPJ-UHFFFAOYSA-N |