2-[(4-benzylpiperidin-1-yl)methyl]-5-(4-methylphenyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
2-[(4-benzylpiperidin-1-yl)methyl]-5-(4-methylphenyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
2-[(4-benzylpiperidin-1-yl)methyl]-5-(4-methylphenyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8013-4723 |
| Compound Name: | 2-[(4-benzylpiperidin-1-yl)methyl]-5-(4-methylphenyl)-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 454.64 |
| Molecular Formula: | C28 H30 N4 S |
| Smiles: | Cc1ccc(cc1)C1=NN(CN2CCC(CC2)Cc2ccccc2)C(N1c1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 6.5431 |
| logD: | 6.0247 |
| logSw: | -6.0428 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 23.3816 |
| InChI Key: | FCXSKWVWZUXSSJ-UHFFFAOYSA-N |