2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(3-phenylpropyl)acetamide
Chemical Structure Depiction of
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(3-phenylpropyl)acetamide
2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(3-phenylpropyl)acetamide
Compound characteristics
| Compound ID: | D585-0049 |
| Compound Name: | 2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]-N-(3-phenylpropyl)acetamide |
| Molecular Weight: | 343.41 |
| Molecular Formula: | C16 H17 N5 O2 S |
| Smiles: | C(Cc1ccccc1)CNC(CSc1nc(c2c(n1)[nH]cn2)O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5532 |
| logD: | 1.0138 |
| logSw: | -2.1157 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.16 |
| InChI Key: | COMFJFYSMPGQNG-UHFFFAOYSA-N |