4-benzyl-2-[(piperidin-1-yl)methyl]-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-benzyl-2-[(piperidin-1-yl)methyl]-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-benzyl-2-[(piperidin-1-yl)methyl]-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8012-2186 |
| Compound Name: | 4-benzyl-2-[(piperidin-1-yl)methyl]-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 365.5 |
| Molecular Formula: | C20 H23 N5 S |
| Smiles: | C1CCN(CC1)CN1C(N(Cc2ccccc2)C(c2ccncc2)=N1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.4368 |
| logD: | 1.0872 |
| logSw: | -3.4486 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 33.693 |
| InChI Key: | ZIRDFKAMFAUBMO-UHFFFAOYSA-N |