4-butyl-5-(4-chloro-1-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-butyl-5-(4-chloro-1-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
4-butyl-5-(4-chloro-1-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 6049-0418 |
| Compound Name: | 4-butyl-5-(4-chloro-1-methyl-1H-pyrazol-3-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 271.77 |
| Molecular Formula: | C10 H14 Cl N5 S |
| Smiles: | CCCCn1c(c2c(cn(C)n2)[Cl])nnc1S |
| Stereo: | ACHIRAL |
| logP: | 1.8808 |
| logD: | 1.7866 |
| logSw: | -2.4214 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.32 |
| InChI Key: | SLOGSCLRNBVWGR-UHFFFAOYSA-N |