4-{[1-(3-chlorophenyl)-1H-tetrazol-5-yl]sulfanyl}butanenitrile
Chemical Structure Depiction of
4-{[1-(3-chlorophenyl)-1H-tetrazol-5-yl]sulfanyl}butanenitrile
4-{[1-(3-chlorophenyl)-1H-tetrazol-5-yl]sulfanyl}butanenitrile
Compound characteristics
| Compound ID: | 8011-6839 |
| Compound Name: | 4-{[1-(3-chlorophenyl)-1H-tetrazol-5-yl]sulfanyl}butanenitrile |
| Molecular Weight: | 279.75 |
| Molecular Formula: | C11 H10 Cl N5 S |
| Smiles: | C(CC#N)CSc1nnnn1c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.1197 |
| logD: | 2.1197 |
| logSw: | -2.5872 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 57.652 |
| InChI Key: | ZILUYGXUDZKKQF-UHFFFAOYSA-N |