2-{[(2-fluorophenyl)methyl]sulfanyl}-N-heptylpyridine-3-carboxamide
Chemical Structure Depiction of
2-{[(2-fluorophenyl)methyl]sulfanyl}-N-heptylpyridine-3-carboxamide
2-{[(2-fluorophenyl)methyl]sulfanyl}-N-heptylpyridine-3-carboxamide
Compound characteristics
| Compound ID: | K845-0019 |
| Compound Name: | 2-{[(2-fluorophenyl)methyl]sulfanyl}-N-heptylpyridine-3-carboxamide |
| Molecular Weight: | 360.49 |
| Molecular Formula: | C20 H25 F N2 O S |
| Smiles: | CCCCCCCNC(c1cccnc1SCc1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5867 |
| logD: | 5.5867 |
| logSw: | -5.2684 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.673 |
| InChI Key: | LVMKQERCPIZMGY-UHFFFAOYSA-N |