1'-butyl-3',5'-dimethyl-5-[3-(propan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-1'H,2H-3,4'-bipyrazole
Chemical Structure Depiction of
1'-butyl-3',5'-dimethyl-5-[3-(propan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-1'H,2H-3,4'-bipyrazole
1'-butyl-3',5'-dimethyl-5-[3-(propan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-1'H,2H-3,4'-bipyrazole
Compound characteristics
| Compound ID: | 8020-3239 |
| Compound Name: | 1'-butyl-3',5'-dimethyl-5-[3-(propan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-1'H,2H-3,4'-bipyrazole |
| Molecular Weight: | 384.5 |
| Molecular Formula: | C18 H24 N8 S |
| Smiles: | CCCCn1c(C)c(c(C)n1)c1cc(c2nn3c(C(C)C)nnc3s2)n[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 3.0977 |
| logD: | 3.0977 |
| logSw: | -3.1047 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.015 |
| InChI Key: | SDVIYEUTFVUTOT-UHFFFAOYSA-N |