N,N,7-tribenzyl-9-(3,4-dimethylphenyl)-8-oxo-2-phenyl-8,9-dihydro-7H-purine-6-carboxamide
Chemical Structure Depiction of
N,N,7-tribenzyl-9-(3,4-dimethylphenyl)-8-oxo-2-phenyl-8,9-dihydro-7H-purine-6-carboxamide
N,N,7-tribenzyl-9-(3,4-dimethylphenyl)-8-oxo-2-phenyl-8,9-dihydro-7H-purine-6-carboxamide
Compound characteristics
| Compound ID: | C429-1139 |
| Compound Name: | N,N,7-tribenzyl-9-(3,4-dimethylphenyl)-8-oxo-2-phenyl-8,9-dihydro-7H-purine-6-carboxamide |
| Molecular Weight: | 629.76 |
| Molecular Formula: | C41 H35 N5 O2 |
| Smiles: | Cc1ccc(cc1C)N1C(N(Cc2ccccc2)c2c(C(N(Cc3ccccc3)Cc3ccccc3)=O)nc(c3ccccc3)nc12)=O |
| Stereo: | ACHIRAL |
| logP: | 9.5237 |
| logD: | 9.5237 |
| logSw: | -5.62 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.687 |
| InChI Key: | VTKCWUAKYZDGLV-UHFFFAOYSA-N |