{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetonitrile
Chemical Structure Depiction of
{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetonitrile
{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetonitrile
Compound characteristics
| Compound ID: | 8018-9492 |
| Compound Name: | {5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetonitrile |
| Molecular Weight: | 231.28 |
| Molecular Formula: | C10 H9 N5 S |
| Smiles: | CSc1ccc(cc1)c1nnn(CC#N)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.9602 |
| logD: | 1.9602 |
| logSw: | -2.06 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 56.083 |
| InChI Key: | XBKKZYSIXMOQTP-UHFFFAOYSA-N |