8-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
8-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
8-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | C301-9725 |
| Compound Name: | 8-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-1,3,7-trimethyl-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 325.37 |
| Molecular Formula: | C10 H11 N7 O2 S2 |
| Smiles: | CN1C(c2c(nc(n2C)Sc2nnc(N)s2)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9023 |
| logD: | 0.9023 |
| logSw: | -1.2181 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 87.759 |
| InChI Key: | LNJDGMXUMYEFRX-UHFFFAOYSA-N |