4-{[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-{[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
4-{[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]amino}-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y502-6100 |
| Compound Name: | 4-{[(1,3-dimethyl-1H-pyrazol-4-yl)methylidene]amino}-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 222.27 |
| Molecular Formula: | C8 H10 N6 S |
| Smiles: | Cc1c(/C=N/n2cnnc2S)cn(C)n1 |
| Stereo: | ACHIRAL |
| logP: | -0.4301 |
| logD: | -0.4908 |
| logSw: | 0.0964 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.55 |
| InChI Key: | HZTKSRGVDPNEHZ-UHFFFAOYSA-N |