6-cyclopropyl-2-{[2-(4-methylbenzene-1-sulfonyl)ethyl]sulfanyl}-4-(trifluoromethyl)pyridine-3-carbonitrile
Chemical Structure Depiction of
6-cyclopropyl-2-{[2-(4-methylbenzene-1-sulfonyl)ethyl]sulfanyl}-4-(trifluoromethyl)pyridine-3-carbonitrile
6-cyclopropyl-2-{[2-(4-methylbenzene-1-sulfonyl)ethyl]sulfanyl}-4-(trifluoromethyl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 6114-0214 |
| Compound Name: | 6-cyclopropyl-2-{[2-(4-methylbenzene-1-sulfonyl)ethyl]sulfanyl}-4-(trifluoromethyl)pyridine-3-carbonitrile |
| Molecular Weight: | 426.48 |
| Molecular Formula: | C19 H17 F3 N2 O2 S2 |
| Smiles: | Cc1ccc(cc1)S(CCSc1c(C#N)c(cc(C2CC2)n1)C(F)(F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8919 |
| logD: | 4.8919 |
| logSw: | -4.8178 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 55.058 |
| InChI Key: | MVTXHJIONTWMED-UHFFFAOYSA-N |