6-(4-chloro-1H-pyrazol-3-yl)-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Chemical Structure Depiction of
6-(4-chloro-1H-pyrazol-3-yl)-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
6-(4-chloro-1H-pyrazol-3-yl)-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Compound characteristics
Compound ID: | 8020-6673 |
Compound Name: | 6-(4-chloro-1H-pyrazol-3-yl)-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole |
Molecular Weight: | 308.77 |
Molecular Formula: | C10 H5 Cl N6 S2 |
Smiles: | c1cc(c2nnc3n2nc(c2c(c[nH]n2)[Cl])s3)sc1 |
Stereo: | ACHIRAL |
logP: | 2.509 |
logD: | 2.509 |
logSw: | -3.2489 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 59.201 |
InChI Key: | RMPXSXBIENWTNF-UHFFFAOYSA-N |