3-(benzylsulfanyl)-1-(piperidin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Chemical Structure Depiction of
3-(benzylsulfanyl)-1-(piperidin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
3-(benzylsulfanyl)-1-(piperidin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Compound characteristics
| Compound ID: | 3966-1175 |
| Compound Name: | 3-(benzylsulfanyl)-1-(piperidin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile |
| Molecular Weight: | 363.52 |
| Molecular Formula: | C22 H25 N3 S |
| Smiles: | C1CCN(CC1)c1c2CCCCc2c(C#N)c(n1)SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.832 |
| logD: | 5.8319 |
| logSw: | -5.953 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 29.0764 |
| InChI Key: | HNXFSWREJXPNSE-UHFFFAOYSA-N |