2-{[(butane-1-sulfinyl)methyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[(butane-1-sulfinyl)methyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
2-{[(butane-1-sulfinyl)methyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4378-0282 |
| Compound Name: | 2-{[(butane-1-sulfinyl)methyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile |
| Molecular Weight: | 412.59 |
| Molecular Formula: | C21 H20 N2 O S3 |
| Smiles: | CCCCS(CSc1c(C#N)c(cc(c2cccs2)n1)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1759 |
| logD: | 6.1759 |
| logSw: | -5.6186 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.561 |
| InChI Key: | PPGWEXFLAWZRLW-UHFFFAOYSA-N |