6-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
| Compound ID: | 8018-7026 |
| Compound Name: | 6-[5-(4-chlorophenyl)-1H-pyrazol-3-yl]-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
| Molecular Weight: | 384.87 |
| Molecular Formula: | C16 H9 Cl N6 S2 |
| Smiles: | c1cc(c2nnc3n2nc(c2cc(c4ccc(cc4)[Cl])[nH]n2)s3)sc1 |
| Stereo: | ACHIRAL |
| logP: | 4.559 |
| logD: | 4.559 |
| logSw: | -4.8569 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.23 |
| InChI Key: | XBNONJCGZLHFPL-UHFFFAOYSA-N |