4-benzyl-5-(4-chlorophenyl)-2-[(piperidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-benzyl-5-(4-chlorophenyl)-2-[(piperidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-benzyl-5-(4-chlorophenyl)-2-[(piperidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8009-3925 |
| Compound Name: | 4-benzyl-5-(4-chlorophenyl)-2-[(piperidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 398.96 |
| Molecular Formula: | C21 H23 Cl N4 S |
| Smiles: | C1CCN(CC1)CN1C(N(Cc2ccccc2)C(c2ccc(cc2)[Cl])=N1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.2806 |
| logD: | 2.931 |
| logSw: | -6.0163 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.2646 |
| InChI Key: | FLVFGHSMMUSRQG-UHFFFAOYSA-N |