8-[benzyl(methyl)amino]-3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[benzyl(methyl)amino]-3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
8-[benzyl(methyl)amino]-3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | G856-5803 |
| Compound Name: | 8-[benzyl(methyl)amino]-3-methyl-7-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]ethyl}-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 489.56 |
| Molecular Formula: | C23 H23 N9 O2 S |
| Smiles: | CN(Cc1ccccc1)c1nc2c(C(NC(N2C)=O)=O)n1CCSc1nnnn1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.3413 |
| logD: | 3.3412 |
| logSw: | -3.6147 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.014 |
| InChI Key: | OOYACPMKHHWMRN-UHFFFAOYSA-N |