2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | D585-0023 |
| Compound Name: | 2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(2-methoxyphenyl)acetamide |
| Molecular Weight: | 331.35 |
| Molecular Formula: | C14 H13 N5 O3 S |
| Smiles: | COc1ccccc1NC(CSc1nc(c2c(n1)[nH]cn2)O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8738 |
| logD: | 0.3343 |
| logSw: | -2.1948 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.929 |
| InChI Key: | JVECGOHNGDFSPC-UHFFFAOYSA-N |