2-{[2-hydroxy-3-(phenylmethanesulfonyl)propyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[2-hydroxy-3-(phenylmethanesulfonyl)propyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
2-{[2-hydroxy-3-(phenylmethanesulfonyl)propyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4379-0522 |
| Compound Name: | 2-{[2-hydroxy-3-(phenylmethanesulfonyl)propyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile |
| Molecular Weight: | 506.66 |
| Molecular Formula: | C26 H22 N2 O3 S3 |
| Smiles: | C(C(CS(Cc1ccccc1)(=O)=O)O)Sc1c(C#N)c(cc(c2cccs2)n1)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1962 |
| logD: | 5.1962 |
| logSw: | -5.4257 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.165 |
| InChI Key: | LUSFUUQUMVKZIX-NRFANRHFSA-N |