6-(4-bromo-3-methyl-1H-pyrazol-5-yl)-3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(4-bromo-3-methyl-1H-pyrazol-5-yl)-3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(4-bromo-3-methyl-1H-pyrazol-5-yl)-3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8020-6630 |
| Compound Name: | 6-(4-bromo-3-methyl-1H-pyrazol-5-yl)-3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 351.18 |
| Molecular Formula: | C11 H7 Br N6 O S |
| Smiles: | Cc1c(c(c2nn3c(c4ccco4)nnc3s2)[nH]n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 1.9808 |
| logD: | 1.9807 |
| logSw: | -2.304 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.409 |
| InChI Key: | NNAVXDQZRMGURK-UHFFFAOYSA-N |