2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-[2-(4-methoxyphenyl)ethyl]acetamide
Chemical Structure Depiction of
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-[2-(4-methoxyphenyl)ethyl]acetamide
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-[2-(4-methoxyphenyl)ethyl]acetamide
Compound characteristics
| Compound ID: | D585-0230 |
| Compound Name: | 2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-[2-(4-methoxyphenyl)ethyl]acetamide |
| Molecular Weight: | 359.4 |
| Molecular Formula: | C16 H17 N5 O3 S |
| Smiles: | COc1ccc(CCNC(CSc2nc(c3c(n2)[nH]cn3)O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 0.5591 |
| logD: | 0.0196 |
| logSw: | -2.0223 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.704 |
| InChI Key: | APOSQBXNVROOKH-UHFFFAOYSA-N |