N-[(2-chlorophenyl)methyl]-2-[(9H-purin-6-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-[(9H-purin-6-yl)sulfanyl]acetamide
N-[(2-chlorophenyl)methyl]-2-[(9H-purin-6-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D691-0108 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-[(9H-purin-6-yl)sulfanyl]acetamide |
| Molecular Weight: | 333.8 |
| Molecular Formula: | C14 H12 Cl N5 O S |
| Smiles: | C(c1ccccc1[Cl])NC(CSc1c2c(ncn1)[nH]cn2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9103 |
| logD: | 1.9101 |
| logSw: | -2.5889 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.006 |
| InChI Key: | PUHUSNJILMVKMT-UHFFFAOYSA-N |