2-{[(4-bromophenyl)methyl]sulfanyl}-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[(4-bromophenyl)methyl]sulfanyl}-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridine-3-carbonitrile
2-{[(4-bromophenyl)methyl]sulfanyl}-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4486-0007 |
| Compound Name: | 2-{[(4-bromophenyl)methyl]sulfanyl}-6-(thiophen-2-yl)-4-(trifluoromethyl)pyridine-3-carbonitrile |
| Molecular Weight: | 455.32 |
| Molecular Formula: | C18 H10 Br F3 N2 S2 |
| Smiles: | C(c1ccc(cc1)[Br])Sc1c(C#N)c(cc(c2cccs2)n1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 6.5978 |
| logD: | 6.5978 |
| logSw: | -6.5336 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.5171 |
| InChI Key: | ZTZQECIOIHQRMC-UHFFFAOYSA-N |