2-[(2-cyclopropyl-2-oxoethyl)sulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile
Chemical Structure Depiction of
2-[(2-cyclopropyl-2-oxoethyl)sulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile
2-[(2-cyclopropyl-2-oxoethyl)sulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8001-1458 |
| Compound Name: | 2-[(2-cyclopropyl-2-oxoethyl)sulfanyl]-6-phenyl-4-(trifluoromethyl)pyridine-3-carbonitrile |
| Molecular Weight: | 362.37 |
| Molecular Formula: | C18 H13 F3 N2 O S |
| Smiles: | C1CC1C(CSc1c(C#N)c(cc(c2ccccc2)n1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1783 |
| logD: | 5.1783 |
| logSw: | -5.4094 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.269 |
| InChI Key: | AUUWHTOYBJAQBT-UHFFFAOYSA-N |