TL;DR: 2-Methoxy-8-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]quinoline (CAS 876721-24-3) is a chemical compound with molecular formula C20H17N3O2 and molecular weight 331.13208 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(2-methoxy-8-methylquinolin-3-yl)-5-(4-methylphenyl)-1,2,4-oxadiazole
Also Known As: BAS 09890798, 3-(2-methoxy-8-methylquinolin-3-yl)-5-(p-tolyl)-1,2,4-oxadiazole, 2-methoxy-8-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]quinoline, 3-(2-methoxy-8-methylquinolin-3-yl)-5-(4-methylphenyl)-1,2,4-oxadiazole, 2-Methoxy-8-methyl-3-(5-p-tolyl-[1,2,4]oxadiazol-3-yl)-quinoline
| Molecular Formula | C20H17N3O2 |
| Molecular Weight | 331.13208 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 61.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.13208 Da |
| Heavy Atoms | 25 |
| Complexity | 441.0 |
| SMILES | CC1=CC=C(C=C1)C2=NC(=NO2)C3=CC4=CC=CC(=C4N=C3OC)C |
| InChIKey | LSVAEOLDGLFLMU-UHFFFAOYSA-N |
The XLogP value of 4.8 indicates that 2-Methoxy-8-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxy-8-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]quinoline. Following Lipinski's Rule of Five, 2-Methoxy-8-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]quinoline 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 2-Methoxy-8-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]quinoline is 876721-24-3.
The molecular formula of 2-Methoxy-8-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]quinoline is C20H17N3O2.
The molecular weight of 2-Methoxy-8-methyl-3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]quinoline is 331.13208 g/mol.
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