N-(4-{[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetyl}phenyl)acetamide
Chemical Structure Depiction of
N-(4-{[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetyl}phenyl)acetamide
N-(4-{[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetyl}phenyl)acetamide
Compound characteristics
| Compound ID: | D071-0025 |
| Compound Name: | N-(4-{[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetyl}phenyl)acetamide |
| Molecular Weight: | 343.36 |
| Molecular Formula: | C15 H13 N5 O3 S |
| Smiles: | CC(Nc1ccc(cc1)C(CSc1nc(c2c(n1)[nH]cn2)O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.4491 |
| logD: | -0.0904 |
| logSw: | -1.9435 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 93.356 |
| InChI Key: | VIKJLBGGCLBTPL-UHFFFAOYSA-N |