1,3-dimethyl-7-(propan-2-yl)-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3-dimethyl-7-(propan-2-yl)-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
1,3-dimethyl-7-(propan-2-yl)-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 3601-0852 |
| Compound Name: | 1,3-dimethyl-7-(propan-2-yl)-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 254.31 |
| Molecular Formula: | C10 H14 N4 O2 S |
| Smiles: | CC(C)n1c2C(N(C)C(N(C)c2nc1S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4881 |
| logD: | 1.4871 |
| logSw: | -1.3961 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.107 |
| InChI Key: | BKUYNTXHKFXBOW-UHFFFAOYSA-N |