3-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]propanenitrile
Chemical Structure Depiction of
3-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]propanenitrile
3-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]propanenitrile
Compound characteristics
| Compound ID: | 8018-5071 |
| Compound Name: | 3-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]propanenitrile |
| Molecular Weight: | 260.34 |
| Molecular Formula: | C11 H8 N4 S2 |
| Smiles: | C(CSc1nnc2n1c1ccccc1s2)C#N |
| Stereo: | ACHIRAL |
| logP: | 1.9708 |
| logD: | 1.9708 |
| logSw: | -1.6856 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.07 |
| InChI Key: | SYUIMZVIMVTWRJ-UHFFFAOYSA-N |