TL;DR: AB01209849-01 (CAS 861643-93-8) is a chemical compound with molecular formula C17H14N8O3S and molecular weight 410.09094 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N-[(E)-thiophen-2-ylmethylideneamino]triazole-4-carboxamide
Also Known As: AB01209849-01, (E)-1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N'-(thiophen-2-ylmethylene)-1H-1,2,3-triazole-4-carbohydrazide, 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N'-[(E)-thiophen-2-ylmethylidene]-1H-1,2,3-triazole-4-carbohydrazide
| Molecular Formula | C17H14N8O3S |
| Molecular Weight | 410.09094 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 175.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.09094 Da |
| Heavy Atoms | 29 |
| Complexity | 599.0 |
| SMILES | COC1=CC=CC(=C1)C2=C(N=NN2C3=NON=C3N)C(=O)N/N=C/C4=CC=CS4 |
| InChIKey | WUFGELHHHUCOLL-DJKKODMXSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB01209849-01. The TPSA of 175.0 Ų indicates high polarity, suggesting AB01209849-01 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, AB01209849-01 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of AB01209849-01 is 861643-93-8.
The molecular formula of AB01209849-01 is C17H14N8O3S.
The molecular weight of AB01209849-01 is 410.09094 g/mol.
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