2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(3-methylbutyl)acetamide
Chemical Structure Depiction of
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(3-methylbutyl)acetamide
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(3-methylbutyl)acetamide
Compound characteristics
| Compound ID: | D585-0016 |
| Compound Name: | 2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(3-methylbutyl)acetamide |
| Molecular Weight: | 295.36 |
| Molecular Formula: | C12 H17 N5 O2 S |
| Smiles: | CC(C)CCNC(CSc1nc(c2c(n1)[nH]cn2)O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.6696 |
| logD: | 0.1302 |
| logSw: | -1.8286 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.431 |
| InChI Key: | LQPHXYSDZHRDGC-UHFFFAOYSA-N |