5-[2-(4-chlorophenyl)cyclopropyl]-4-(1,3-dimethyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-[2-(4-chlorophenyl)cyclopropyl]-4-(1,3-dimethyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol
5-[2-(4-chlorophenyl)cyclopropyl]-4-(1,3-dimethyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y502-4286 |
| Compound Name: | 5-[2-(4-chlorophenyl)cyclopropyl]-4-(1,3-dimethyl-1H-pyrazol-4-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 345.85 |
| Molecular Formula: | C16 H16 Cl N5 S |
| Smiles: | Cc1c(cn(C)n1)n1c(C2CC2c2ccc(cc2)[Cl])nnc1S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.6771 |
| logD: | 0.6139 |
| logSw: | -3.4585 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.57 |
| InChI Key: | QLPAOHKFUILJPP-UHFFFAOYSA-N |