1,3-dimethyl-8-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-8-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-8-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 8011-8717 |
| Compound Name: | 1,3-dimethyl-8-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-7-(propan-2-yl)-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 334.4 |
| Molecular Formula: | C14 H18 N6 O2 S |
| Smiles: | CC(C)n1c2C(N(C)C(N(C)c2nc1Sc1nccn1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7174 |
| logD: | 1.7066 |
| logSw: | -1.9564 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.28 |
| InChI Key: | CGQBOVIIOVEYMO-UHFFFAOYSA-N |