N-benzyl-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-benzyl-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
N-benzyl-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D071-0055 |
| Compound Name: | N-benzyl-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 315.35 |
| Molecular Formula: | C14 H13 N5 O2 S |
| Smiles: | C(c1ccccc1)NC(CSc1nc(c2c(n1)[nH]cn2)O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.802 |
| logD: | 0.2625 |
| logSw: | -1.961 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.318 |
| InChI Key: | NUWVOIQVTCGJLX-UHFFFAOYSA-N |