5-phenyl-2-[(piperidin-1-yl)methyl]-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-phenyl-2-[(piperidin-1-yl)methyl]-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-phenyl-2-[(piperidin-1-yl)methyl]-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8016-2778 |
| Compound Name: | 5-phenyl-2-[(piperidin-1-yl)methyl]-4-(prop-2-en-1-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 314.45 |
| Molecular Formula: | C17 H22 N4 S |
| Smiles: | C=CCN1C(c2ccccc2)=NN(CN2CCCCC2)C1=S |
| Stereo: | ACHIRAL |
| logP: | 3.4647 |
| logD: | 1.0621 |
| logSw: | -3.605 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.5146 |
| InChI Key: | GRWNEOBDKUMPKN-UHFFFAOYSA-N |