2-(benzylsulfanyl)-4-methoxybenzonitrile
Chemical Structure Depiction of
2-(benzylsulfanyl)-4-methoxybenzonitrile
2-(benzylsulfanyl)-4-methoxybenzonitrile
Compound characteristics
| Compound ID: | 8011-9700 |
| Compound Name: | 2-(benzylsulfanyl)-4-methoxybenzonitrile |
| Molecular Weight: | 255.34 |
| Molecular Formula: | C15 H13 N O S |
| Smiles: | COc1ccc(C#N)c(c1)SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4897 |
| logD: | 3.4897 |
| logSw: | -3.8673 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.5669 |
| InChI Key: | XKORWKDFERVRPZ-UHFFFAOYSA-N |