4-(1-benzyl-1H-pyrazol-4-yl)-5-(2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(1-benzyl-1H-pyrazol-4-yl)-5-(2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol
4-(1-benzyl-1H-pyrazol-4-yl)-5-(2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y502-9800 |
| Compound Name: | 4-(1-benzyl-1H-pyrazol-4-yl)-5-(2-phenylcyclopropyl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 373.48 |
| Molecular Formula: | C21 H19 N5 S |
| Smiles: | C1C(C1c1nnc(n1c1cnn(Cc2ccccc2)c1)S)c1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6087 |
| logD: | 2.4851 |
| logSw: | -3.3641 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.215 |
| InChI Key: | GKABADWWWJNTCF-UHFFFAOYSA-N |