5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 6049-0409 |
| Compound Name: | 5-[(3,5-dimethyl-1H-pyrazol-1-yl)methyl]-4-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 299.4 |
| Molecular Formula: | C15 H17 N5 S |
| Smiles: | Cc1cccc(c1)n1c(Cn2c(C)cc(C)n2)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 1.5668 |
| logD: | 0.3075 |
| logSw: | -0.8925 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.441 |
| InChI Key: | QNJMZKZBRZJPLQ-UHFFFAOYSA-N |