TL;DR: 2-[2-(4-Methylphenyl)vinyl]-5-phenyl-1,3,4-oxadiazole (CAS 1164505-17-2) is a chemical compound with molecular formula C17H14N2O and molecular weight 262.11063 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(E)-2-(4-methylphenyl)ethenyl]-5-phenyl-1,3,4-oxadiazole
Also Known As: 2-[2-(4-methylphenyl)vinyl]-5-phenyl-1,3,4-oxadiazole, 2-[(E)-2-(4-methylphenyl)ethenyl]-5-phenyl-1,3,4-oxadiazole, AN-329/42344178, 5-[(1E)-2-(4-methylphenyl)vinyl]-2-phenyl-1,3,4-oxadiazole
| Molecular Formula | C17H14N2O |
| Molecular Weight | 262.11063 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 38.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 262.11063 Da |
| Heavy Atoms | 20 |
| Complexity | 317.0 |
| SMILES | CC1=CC=C(C=C1)/C=C/C2=NN=C(O2)C3=CC=CC=C3 |
| InChIKey | PQHPYNGPKZJEBW-VAWYXSNFSA-N |
The XLogP value of 4.1 indicates that 2-[2-(4-Methylphenyl)vinyl]-5-phenyl-1,3,4-oxadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.9 Ų, 2-[2-(4-Methylphenyl)vinyl]-5-phenyl-1,3,4-oxadiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[2-(4-Methylphenyl)vinyl]-5-phenyl-1,3,4-oxadiazole has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-[2-(4-Methylphenyl)vinyl]-5-phenyl-1,3,4-oxadiazole is 1164505-17-2.
The molecular formula of 2-[2-(4-Methylphenyl)vinyl]-5-phenyl-1,3,4-oxadiazole is C17H14N2O.
The molecular weight of 2-[2-(4-Methylphenyl)vinyl]-5-phenyl-1,3,4-oxadiazole is 262.11063 g/mol.
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