7-(2-methoxyethyl)-3-methyl-8-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
7-(2-methoxyethyl)-3-methyl-8-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
7-(2-methoxyethyl)-3-methyl-8-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | D226-0159 |
| Compound Name: | 7-(2-methoxyethyl)-3-methyl-8-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 353.42 |
| Molecular Formula: | C13 H15 N5 O3 S2 |
| Smiles: | Cc1csc(n1)Sc1nc2c(C(NC(N2C)=O)=O)n1CCOC |
| Stereo: | ACHIRAL |
| logP: | 2.0606 |
| logD: | 2.0599 |
| logSw: | -2.6052 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.694 |
| InChI Key: | JBYHXINHJVHHKT-UHFFFAOYSA-N |