5-[(3,4-dimethylphenoxy)methyl]-4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-[(3,4-dimethylphenoxy)methyl]-4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-[(3,4-dimethylphenoxy)methyl]-4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8008-8386 |
| Compound Name: | 5-[(3,4-dimethylphenoxy)methyl]-4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 360.52 |
| Molecular Formula: | C19 H28 N4 O S |
| Smiles: | CC1CCN(CC1)CN1C(N(C)C(COc2ccc(C)c(C)c2)=N1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.9733 |
| logD: | -0.1914 |
| logSw: | -3.9998 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.657 |
| InChI Key: | SNEOOZJCUIEAMA-UHFFFAOYSA-N |