(azepan-2-ylidene)(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl)acetonitrile
Chemical Structure Depiction of
(azepan-2-ylidene)(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl)acetonitrile
(azepan-2-ylidene)(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl)acetonitrile
Compound characteristics
| Compound ID: | 8017-9560 |
| Compound Name: | (azepan-2-ylidene)(5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3-yl)acetonitrile |
| Molecular Weight: | 257.34 |
| Molecular Formula: | C14 H19 N5 |
| Smiles: | C1CC/C(=C(\C#N)c2nnc3CCCCn23)NCC1 |
| Stereo: | ACHIRAL |
| logP: | 1.0493 |
| logD: | 1.0493 |
| logSw: | -0.8223 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.155 |
| InChI Key: | WGACJBUXRZGIEH-UHFFFAOYSA-N |