5-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-4-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-4-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol
5-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-4-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y502-5713 |
| Compound Name: | 5-[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)ethyl]-4-(1-ethyl-5-methyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 365.89 |
| Molecular Formula: | C15 H20 Cl N7 S |
| Smiles: | CCn1c(C)c(cn1)n1c(CCn2c(C)c(c(C)n2)[Cl])nnc1S |
| Stereo: | ACHIRAL |
| logP: | 1.0708 |
| logD: | -0.4856 |
| logSw: | -2.2333 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.59 |
| InChI Key: | BVYPNAWMHWTUDV-UHFFFAOYSA-N |