TL;DR: AO-365/43113298 (CAS 167558-34-1) is a chemical compound with molecular formula C16H10FN7S and molecular weight 351.07025 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(benzotriazol-1-ylmethyl)-6-(3-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: AO-365/43113298, 1-{[6-(3-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-1,2,3-benzotriazole, 3-(benzotriazol-1-ylmethyl)-6-(3-fluorophenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 1-{[6-(3-FLUOROPHENYL)-[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZOL-3-YL]METHYL}-1H-1,2,3-BENZOTRIAZOLE, 1-{[6-(3-fluorophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-3-yl]methyl}-1H-benzotriazole
| Molecular Formula | C16H10FN7S |
| Molecular Weight | 351.07025 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.07025 Da |
| Heavy Atoms | 25 |
| Complexity | 485.0 |
| SMILES | C1=CC=C2C(=C1)N=NN2CC3=NN=C4N3N=C(S4)C5=CC(=CC=C5)F |
| InChIKey | HNYXILOYZDAKIG-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AO-365/43113298. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AO-365/43113298. Following Lipinski's Rule of Five, AO-365/43113298 has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of AO-365/43113298 is 167558-34-1.
The molecular formula of AO-365/43113298 is C16H10FN7S.
The molecular weight of AO-365/43113298 is 351.07025 g/mol.
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