2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(2-methylphenyl)acetamide
Chemical Structure Depiction of
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(2-methylphenyl)acetamide
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(2-methylphenyl)acetamide
Compound characteristics
Compound ID: | D585-0035 |
Compound Name: | 2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(2-methylphenyl)acetamide |
Molecular Weight: | 315.35 |
Molecular Formula: | C14 H13 N5 O2 S |
Smiles: | Cc1ccccc1NC(CSc1nc(c2c(n1)[nH]cn2)O)=O |
Stereo: | ACHIRAL |
logP: | 0.9155 |
logD: | 0.3761 |
logSw: | -2.1893 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 79.298 |
InChI Key: | SJJZEWZESYUKPG-UHFFFAOYSA-N |