2-{[2-(azepan-1-yl)ethyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-(azepan-1-yl)ethyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
2-{[2-(azepan-1-yl)ethyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 8007-0189 |
| Compound Name: | 2-{[2-(azepan-1-yl)ethyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile |
| Molecular Weight: | 419.61 |
| Molecular Formula: | C24 H25 N3 S2 |
| Smiles: | C1CCCN(CC1)CCSc1c(C#N)c(cc(c2cccs2)n1)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.3588 |
| logD: | 5.4251 |
| logSw: | -6.2679 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.5591 |
| InChI Key: | OFWWGIXRAJJKFT-UHFFFAOYSA-N |