2-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-sulfanylideneethyl]sulfanyl}-6-(4-fluorophenyl)-4-(furan-2-yl)pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-sulfanylideneethyl]sulfanyl}-6-(4-fluorophenyl)-4-(furan-2-yl)pyridine-3-carbonitrile
2-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-sulfanylideneethyl]sulfanyl}-6-(4-fluorophenyl)-4-(furan-2-yl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 6049-1055 |
| Compound Name: | 2-{[2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-sulfanylideneethyl]sulfanyl}-6-(4-fluorophenyl)-4-(furan-2-yl)pyridine-3-carbonitrile |
| Molecular Weight: | 448.54 |
| Molecular Formula: | C23 H17 F N4 O S2 |
| Smiles: | Cc1cc(C)n(C(CSc2c(C#N)c(cc(c3ccc(cc3)F)n2)c2ccco2)=S)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2897 |
| logD: | 5.2879 |
| logSw: | -5.5218 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.409 |
| InChI Key: | DXRXXSCDZSCKLU-UHFFFAOYSA-N |