N-(2-ethyl-6-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2-ethyl-6-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
N-(2-ethyl-6-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D691-0064 |
| Compound Name: | N-(2-ethyl-6-methylphenyl)-2-[(9H-purin-6-yl)sulfanyl]acetamide |
| Molecular Weight: | 327.41 |
| Molecular Formula: | C16 H17 N5 O S |
| Smiles: | CCc1cccc(C)c1NC(CSc1c2c(ncn1)[nH]cn2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1156 |
| logD: | 2.1155 |
| logSw: | -2.5061 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.288 |
| InChI Key: | RVUYEOYVQHSSDX-UHFFFAOYSA-N |