5-[2-(4-benzylpiperazin-1-yl)ethyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
5-[2-(4-benzylpiperazin-1-yl)ethyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
5-[2-(4-benzylpiperazin-1-yl)ethyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | G856-6089 |
| Compound Name: | 5-[2-(4-benzylpiperazin-1-yl)ethyl]-4-phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 379.53 |
| Molecular Formula: | C21 H25 N5 S |
| Smiles: | C(CN1CCN(CC1)Cc1ccccc1)C1=NNC(N1c1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 2.8066 |
| logD: | 2.8066 |
| logSw: | -3.0082 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.352 |
| InChI Key: | GLEFOAXXAIODRL-UHFFFAOYSA-N |