3-(butylsulfanyl)[1,2,4]triazolo[3,4-b][1,3]benzothiazole
Chemical Structure Depiction of
3-(butylsulfanyl)[1,2,4]triazolo[3,4-b][1,3]benzothiazole
3-(butylsulfanyl)[1,2,4]triazolo[3,4-b][1,3]benzothiazole
Compound characteristics
| Compound ID: | 4065-0411 |
| Compound Name: | 3-(butylsulfanyl)[1,2,4]triazolo[3,4-b][1,3]benzothiazole |
| Molecular Weight: | 263.38 |
| Molecular Formula: | C12 H13 N3 S2 |
| Smiles: | CCCCSc1nnc2n1c1ccccc1s2 |
| Stereo: | ACHIRAL |
| logP: | 3.9669 |
| logD: | 3.9668 |
| logSw: | -3.9263 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 22.5782 |
| InChI Key: | JJMOUYPQUNZHQG-UHFFFAOYSA-N |