TL;DR: 2-[5-(3-Methoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline (CAS 159222-58-9) is a chemical compound with molecular formula C15H13N3O2 and molecular weight 267.10077 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline
Also Known As: 2-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline, 2-(5-(3-Methoxyphenyl)-1,3,4-oxadiazol-2-yl)aniline, 2-(2-AMINOPHENYL)-5-(3-METHOXYPHENYL)-1,3,4-OXADIAZOLE, 2-[5-(3-Methoxy-phenyl)-[1,3,4]oxadiazol-2-yl]-phenylamine, Benzenamine,2-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-
| Molecular Formula | C15H13N3O2 |
| Molecular Weight | 267.10077 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 74.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.10077 Da |
| Heavy Atoms | 20 |
| Complexity | 315.0 |
| SMILES | COC1=CC=CC(=C1)C2=NN=C(O2)C3=CC=CC=C3N |
| InChIKey | NYEKSAGNQLAWQF-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[5-(3-Methoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline. The TPSA of 74.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[5-(3-Methoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline. Following Lipinski's Rule of Five, 2-[5-(3-Methoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline has 1 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-[5-(3-Methoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline is 159222-58-9.
The molecular formula of 2-[5-(3-Methoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline is C15H13N3O2.
The molecular weight of 2-[5-(3-Methoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline is 267.10077 g/mol.
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