5-(4-bromo-1-methyl-1H-pyrazol-3-yl)-4-cyclopropyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(4-bromo-1-methyl-1H-pyrazol-3-yl)-4-cyclopropyl-4H-1,2,4-triazole-3-thiol
5-(4-bromo-1-methyl-1H-pyrazol-3-yl)-4-cyclopropyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y500-3938 |
| Compound Name: | 5-(4-bromo-1-methyl-1H-pyrazol-3-yl)-4-cyclopropyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 300.18 |
| Molecular Formula: | C9 H10 Br N5 S |
| Smiles: | Cn1cc(c(c2nnc(n2C2CC2)S)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.1889 |
| logD: | 1.1516 |
| logSw: | -0.9856 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.977 |
| InChI Key: | CKGNZAFSDUDXRV-UHFFFAOYSA-N |