N-(4-acetamidophenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(4-acetamidophenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
N-(4-acetamidophenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D071-0054 |
| Compound Name: | N-(4-acetamidophenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 358.38 |
| Molecular Formula: | C15 H14 N6 O3 S |
| Smiles: | CC(Nc1ccc(cc1)NC(CSc1nc(c2c(n1)[nH]cn2)O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3219 |
| logD: | -0.2176 |
| logSw: | -1.9773 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 103.258 |
| InChI Key: | PHBFHZPAVXQZSO-UHFFFAOYSA-N |