3-(pyridin-3-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[3,4-b][1,3]thiazepine
Chemical Structure Depiction of
3-(pyridin-3-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[3,4-b][1,3]thiazepine
3-(pyridin-3-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[3,4-b][1,3]thiazepine
Compound characteristics
| Compound ID: | 8019-7033 |
| Compound Name: | 3-(pyridin-3-yl)-5,6,7,8-tetrahydro[1,2,4]triazolo[3,4-b][1,3]thiazepine |
| Molecular Weight: | 232.3 |
| Molecular Formula: | C11 H12 N4 S |
| Smiles: | C1CCSc2nnc(c3cccnc3)n2C1 |
| Stereo: | ACHIRAL |
| logP: | 1.4557 |
| logD: | 1.439 |
| logSw: | -1.0219 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.673 |
| InChI Key: | FTEVTVLWPYPZNI-UHFFFAOYSA-N |