N-(2-chlorophenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-chlorophenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
N-(2-chlorophenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D585-0179 |
| Compound Name: | N-(2-chlorophenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 335.77 |
| Molecular Formula: | C13 H10 Cl N5 O2 S |
| Smiles: | C(C(Nc1ccccc1[Cl])=O)Sc1nc(c2c(n1)[nH]cn2)O |
| Stereo: | ACHIRAL |
| logP: | 1.1714 |
| logD: | 0.632 |
| logSw: | -2.3271 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.298 |
| InChI Key: | ZZHJMSHTLIKQHG-UHFFFAOYSA-N |