1,3,9-trimethyl-8-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3,9-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1,3,9-trimethyl-8-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3,9-dihydro-1H-purine-2,6-dione
1,3,9-trimethyl-8-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3,9-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | G856-8474 |
| Compound Name: | 1,3,9-trimethyl-8-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3,9-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 365.45 |
| Molecular Formula: | C16 H23 N5 O3 S |
| Smiles: | CC1CCN(CC1)C(CSc1nc2C(N(C)C(N(C)c2n1C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6758 |
| logD: | 1.6758 |
| logSw: | -2.0002 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.432 |
| InChI Key: | ZGOLQNKKDFGJBU-UHFFFAOYSA-N |