5-(3,4-dimethoxyphenyl)-2-[(4-methylpiperidin-1-yl)methyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-(3,4-dimethoxyphenyl)-2-[(4-methylpiperidin-1-yl)methyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-(3,4-dimethoxyphenyl)-2-[(4-methylpiperidin-1-yl)methyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8007-7504 |
| Compound Name: | 5-(3,4-dimethoxyphenyl)-2-[(4-methylpiperidin-1-yl)methyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 424.56 |
| Molecular Formula: | C23 H28 N4 O2 S |
| Smiles: | CC1CCN(CC1)CN1C(N(C(c2ccc(c(c2)OC)OC)=N1)c1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.0777 |
| logD: | 3.2226 |
| logSw: | -4.2306 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 38.914 |
| InChI Key: | OMYYDPMACRKVES-UHFFFAOYSA-N |