4-phenyl-5-(1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-phenyl-5-(1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
4-phenyl-5-(1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8018-5622 |
| Compound Name: | 4-phenyl-5-(1H-pyrazol-5-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 243.29 |
| Molecular Formula: | C11 H9 N5 S |
| Smiles: | c1ccc(cc1)n1c(c2ccn[nH]2)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 1.5422 |
| logD: | 0.6514 |
| logSw: | -1.3928 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.059 |
| InChI Key: | HLCUHTJHQMRWAP-UHFFFAOYSA-N |