2-[(4-ethylpiperazin-1-yl)methyl]-4-phenyl-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
2-[(4-ethylpiperazin-1-yl)methyl]-4-phenyl-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
2-[(4-ethylpiperazin-1-yl)methyl]-4-phenyl-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | G856-6174 |
| Compound Name: | 2-[(4-ethylpiperazin-1-yl)methyl]-4-phenyl-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 380.51 |
| Molecular Formula: | C20 H24 N6 S |
| Smiles: | CCN1CCN(CC1)CN1C(N(C(c2ccncc2)=N1)c1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 1.9907 |
| logD: | 0.4832 |
| logSw: | -1.6645 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 36.618 |
| InChI Key: | SHFKKYSSKLYHSH-UHFFFAOYSA-N |