4-methyl-5-phenyl-2-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Chemical Structure Depiction of
4-methyl-5-phenyl-2-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
4-methyl-5-phenyl-2-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Compound characteristics
| Compound ID: | 8008-4552 |
| Compound Name: | 4-methyl-5-phenyl-2-({4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}methyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione |
| Molecular Weight: | 433.5 |
| Molecular Formula: | C21 H22 F3 N5 S |
| Smiles: | CN1C(c2ccccc2)=NN(CN2CCN(CC2)c2cccc(c2)C(F)(F)F)C1=S |
| Stereo: | ACHIRAL |
| logP: | 4.1652 |
| logD: | 3.6506 |
| logSw: | -4.1958 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.5622 |
| InChI Key: | GJYMWANMDABANZ-UHFFFAOYSA-N |