2-[(cyanomethyl)sulfanyl]-4-(pyridin-3-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-[(cyanomethyl)sulfanyl]-4-(pyridin-3-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
2-[(cyanomethyl)sulfanyl]-4-(pyridin-3-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | Y500-0462 |
| Compound Name: | 2-[(cyanomethyl)sulfanyl]-4-(pyridin-3-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile |
| Molecular Weight: | 306.39 |
| Molecular Formula: | C17 H14 N4 S |
| Smiles: | C1CCc2c(C1)c(c1cccnc1)c(C#N)c(n2)SCC#N |
| Stereo: | ACHIRAL |
| logP: | 2.8506 |
| logD: | 2.8492 |
| logSw: | -2.7646 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.201 |
| InChI Key: | KQWKROXJBVFRSR-UHFFFAOYSA-N |