methyl [(6-hydroxy-9H-purin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
methyl [(6-hydroxy-9H-purin-2-yl)sulfanyl]acetate
methyl [(6-hydroxy-9H-purin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | D585-0099 |
| Compound Name: | methyl [(6-hydroxy-9H-purin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 240.24 |
| Molecular Formula: | C8 H8 N4 O3 S |
| Smiles: | COC(CSc1nc(c2c(n1)[nH]cn2)O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.2593 |
| logD: | -0.7988 |
| logSw: | -1.8317 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.697 |
| InChI Key: | HTTUMEDYGZZRKQ-UHFFFAOYSA-N |