N-(2,6-dimethylphenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]propanamide
Chemical Structure Depiction of
N-(2,6-dimethylphenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]propanamide
N-(2,6-dimethylphenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]propanamide
Compound characteristics
| Compound ID: | D585-0575 |
| Compound Name: | N-(2,6-dimethylphenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]propanamide |
| Molecular Weight: | 343.41 |
| Molecular Formula: | C16 H17 N5 O2 S |
| Smiles: | CC(C(Nc1c(C)cccc1C)=O)Sc1nc(c2c(n1)[nH]cn2)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0368 |
| logD: | 1.4974 |
| logSw: | -2.4712 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.814 |
| InChI Key: | QFIIPWLLMCRUIK-JTQLQIEISA-N |