2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}acetamide
Chemical Structure Depiction of
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}acetamide
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}acetamide
Compound characteristics
| Compound ID: | D585-0213 |
| Compound Name: | 2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-{4-[(1,3-thiazol-2-yl)sulfamoyl]phenyl}acetamide |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C16 H13 N7 O4 S3 |
| Smiles: | C(C(Nc1ccc(cc1)S(Nc1nccs1)(=O)=O)=O)Sc1nc(c2c(n1)[nH]cn2)O |
| Stereo: | ACHIRAL |
| logP: | 0.8105 |
| logD: | 0.2711 |
| logSw: | -2.3376 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 131.124 |
| InChI Key: | QCGYDXFBABBGFD-UHFFFAOYSA-N |