4-(1-benzyl-1H-pyrazol-4-yl)-5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(1-benzyl-1H-pyrazol-4-yl)-5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
4-(1-benzyl-1H-pyrazol-4-yl)-5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y502-8946 |
| Compound Name: | 4-(1-benzyl-1H-pyrazol-4-yl)-5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 351.43 |
| Molecular Formula: | C17 H17 N7 S |
| Smiles: | Cc1ccn(Cc2nnc(n2c2cnn(Cc3ccccc3)c2)S)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.8408 |
| logD: | 0.1638 |
| logSw: | -0.6861 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.406 |
| InChI Key: | FTDVFHRAOCQNLP-UHFFFAOYSA-N |