N-(2-chloropyridin-3-yl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-chloropyridin-3-yl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
N-(2-chloropyridin-3-yl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D585-0067 |
| Compound Name: | N-(2-chloropyridin-3-yl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 336.76 |
| Molecular Formula: | C12 H9 Cl N6 O2 S |
| Smiles: | C(C(Nc1cccnc1[Cl])=O)Sc1nc(c2c(n1)[nH]cn2)O |
| Stereo: | ACHIRAL |
| logP: | 0.3585 |
| logD: | -0.1809 |
| logSw: | -2.4069 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.984 |
| InChI Key: | LSXWOWBRSRMTEZ-UHFFFAOYSA-N |