4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-(phenoxymethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-(phenoxymethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-(phenoxymethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8008-4744 |
| Compound Name: | 4-methyl-2-[(4-methylpiperidin-1-yl)methyl]-5-(phenoxymethyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 332.47 |
| Molecular Formula: | C17 H24 N4 O S |
| Smiles: | CC1CCN(CC1)CN1C(N(C)C(COc2ccccc2)=N1)=S |
| Stereo: | ACHIRAL |
| logP: | 2.9084 |
| logD: | -1.2563 |
| logSw: | -3.1448 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 31.657 |
| InChI Key: | IPIIOMGIHZSYLL-UHFFFAOYSA-N |