8-[(2-hydroxyethyl)sulfanyl]-3-methyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(2-hydroxyethyl)sulfanyl]-3-methyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
8-[(2-hydroxyethyl)sulfanyl]-3-methyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 2516-4695 |
| Compound Name: | 8-[(2-hydroxyethyl)sulfanyl]-3-methyl-7-propyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 284.33 |
| Molecular Formula: | C11 H16 N4 O3 S |
| Smiles: | CCCn1c2C(NC(N(C)c2nc1SCCO)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9217 |
| logD: | 0.9215 |
| logSw: | -1.8979 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.106 |
| InChI Key: | ZDQPQPMTUOPLGB-UHFFFAOYSA-N |