2-{[3-(4-chloroanilino)-2-hydroxypropyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
Chemical Structure Depiction of
2-{[3-(4-chloroanilino)-2-hydroxypropyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
2-{[3-(4-chloroanilino)-2-hydroxypropyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile
Compound characteristics
| Compound ID: | 4379-0531 |
| Compound Name: | 2-{[3-(4-chloroanilino)-2-hydroxypropyl]sulfanyl}-4-phenyl-6-(thiophen-2-yl)pyridine-3-carbonitrile |
| Molecular Weight: | 478.03 |
| Molecular Formula: | C25 H20 Cl N3 O S2 |
| Smiles: | C(C(CSc1c(C#N)c(cc(c2cccs2)n1)c1ccccc1)O)Nc1ccc(cc1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8476 |
| logD: | 6.8476 |
| logSw: | -6.605 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.371 |
| InChI Key: | KAOKRCORMQRHCQ-FQEVSTJZSA-N |