5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4-propyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4-propyl-4H-1,2,4-triazole-3-thiol
5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4-propyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y500-8572 |
| Compound Name: | 5-[(3-methyl-1H-pyrazol-1-yl)methyl]-4-propyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 237.32 |
| Molecular Formula: | C10 H15 N5 S |
| Smiles: | CCCn1c(Cn2ccc(C)n2)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 0.6277 |
| logD: | 0.4198 |
| logSw: | -0.7944 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.407 |
| InChI Key: | KLOVDHGOKAFWLN-UHFFFAOYSA-N |