4-(3-methoxypropyl)-5-[2-(4-methyl-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-(3-methoxypropyl)-5-[2-(4-methyl-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol
4-(3-methoxypropyl)-5-[2-(4-methyl-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y501-5803 |
| Compound Name: | 4-(3-methoxypropyl)-5-[2-(4-methyl-1H-pyrazol-1-yl)ethyl]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 281.38 |
| Molecular Formula: | C12 H19 N5 O S |
| Smiles: | Cc1cnn(CCc2nnc(n2CCCOC)S)c1 |
| Stereo: | ACHIRAL |
| logP: | 0.5738 |
| logD: | 0.3647 |
| logSw: | -0.4028 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.039 |
| InChI Key: | FDLLAXZWWKACDE-UHFFFAOYSA-N |