3-(3-bromo-4-fluorophenyl)-6-(1-ethyl-5-methyl-1H-pyrazol-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
3-(3-bromo-4-fluorophenyl)-6-(1-ethyl-5-methyl-1H-pyrazol-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
3-(3-bromo-4-fluorophenyl)-6-(1-ethyl-5-methyl-1H-pyrazol-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8020-4202 |
| Compound Name: | 3-(3-bromo-4-fluorophenyl)-6-(1-ethyl-5-methyl-1H-pyrazol-3-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 407.26 |
| Molecular Formula: | C15 H12 Br F N6 S |
| Smiles: | CCn1c(C)cc(c2nn3c(c4ccc(c(c4)[Br])F)nnc3s2)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.4891 |
| logD: | 3.4891 |
| logSw: | -3.6069 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 47.647 |
| InChI Key: | KRCCIBSVHSRQEZ-UHFFFAOYSA-N |