N-(3-fluoro-4-methylphenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(3-fluoro-4-methylphenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
N-(3-fluoro-4-methylphenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | D585-0046 |
| Compound Name: | N-(3-fluoro-4-methylphenyl)-2-[(6-hydroxy-9H-purin-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 333.34 |
| Molecular Formula: | C14 H12 F N5 O2 S |
| Smiles: | Cc1ccc(cc1F)NC(CSc1nc(c2c(n1)[nH]cn2)O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7704 |
| logD: | 1.231 |
| logSw: | -2.4624 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.996 |
| InChI Key: | OFIJVQBFYYLISW-UHFFFAOYSA-N |