4-({[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5-propylfuran-2-carbonitrile
Chemical Structure Depiction of
4-({[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5-propylfuran-2-carbonitrile
4-({[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5-propylfuran-2-carbonitrile
Compound characteristics
| Compound ID: | 8017-3943 |
| Compound Name: | 4-({[5-(3-fluorophenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5-propylfuran-2-carbonitrile |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C23 H19 F N4 O S |
| Smiles: | CCCc1c(CSc2nnc(c3cccc(c3)F)n2c2ccccc2)cc(C#N)o1 |
| Stereo: | ACHIRAL |
| logP: | 5.7837 |
| logD: | 5.7837 |
| logSw: | -5.649 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.014 |
| InChI Key: | QQTDNXRDFOCFPO-UHFFFAOYSA-N |