4-(1-benzyl-1H-pyrazol-4-yl)-5-[1-(4-chloro-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(1-benzyl-1H-pyrazol-4-yl)-5-[1-(4-chloro-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol
4-(1-benzyl-1H-pyrazol-4-yl)-5-[1-(4-chloro-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y502-8954 |
| Compound Name: | 4-(1-benzyl-1H-pyrazol-4-yl)-5-[1-(4-chloro-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 385.88 |
| Molecular Formula: | C17 H16 Cl N7 S |
| Smiles: | CC(c1nnc(n1c1cnn(Cc2ccccc2)c1)S)n1cc(cn1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.139 |
| logD: | 1.4621 |
| logSw: | -2.4611 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.545 |
| InChI Key: | OGYJFMAQILLTNG-LBPRGKRZSA-N |