4-{3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazol-4-yl}-5-(1,5-dimethyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-{3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazol-4-yl}-5-(1,5-dimethyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
4-{3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazol-4-yl}-5-(1,5-dimethyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y503-1832 |
| Compound Name: | 4-{3,5-dimethyl-1-[(4-methylphenyl)methyl]-1H-pyrazol-4-yl}-5-(1,5-dimethyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 393.51 |
| Molecular Formula: | C20 H23 N7 S |
| Smiles: | Cc1ccc(Cn2c(C)c(c(C)n2)n2c(c3cc(C)n(C)n3)nnc2S)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.1073 |
| logD: | -0.0063 |
| logSw: | -1.9444 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.624 |
| InChI Key: | RHTRTPGLZQOUNY-UHFFFAOYSA-N |