TL;DR: 3-Pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole (CAS 133847-06-0) is a chemical compound with molecular formula C8H5N5S and molecular weight 203.02657 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: 3-(4-Pyridinyl)-1,2,4-triazolo[3,4-b][1,3,4]thiadiazole, 3-pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, YU142670, >=98% (HPLC), AO-365/43113532, YU142670, YU 142670, YU-142670
| Molecular Formula | C8H5N5S |
| Molecular Weight | 203.02657 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 84.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 203.02657 Da |
| Heavy Atoms | 14 |
| Complexity | 208.0 |
| SMILES | C1=CN=CC=C1C2=NN=C3N2N=CS3 |
| InChIKey | HRBYAJQMVADJHW-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole. Following Lipinski's Rule of Five, 3-Pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 133847-06-0.
The molecular formula of 3-Pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is C8H5N5S.
The molecular weight of 3-Pyridin-4-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole is 203.02657 g/mol.
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