TL;DR: Phenol, 2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]- (CAS 114333-42-5) is a chemical compound with molecular formula C15H12N2O3 and molecular weight 268.08478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]phenol
Also Known As: 2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]phenol, Phenol, 2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-, Peroxide,11-bromo-1-oxoundecyl 1-oxododecyl, J2.342.471A, 2-(4-Methoxyphenyl)-5-(2-hydroxyphenyl)-1,3,4-oxadiazole
| Molecular Formula | C15H12N2O3 |
| Molecular Weight | 268.08478 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 68.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.08478 Da |
| Heavy Atoms | 20 |
| Complexity | 307.0 |
| SMILES | COC1=CC=C(C=C1)C2=NN=C(O2)C3=CC=CC=C3O |
| InChIKey | NOZPDMPDJUURTF-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-. The TPSA of 68.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Phenol, 2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-. Following Lipinski's Rule of Five, Phenol, 2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]- 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 Phenol, 2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]- is 114333-42-5.
The molecular formula of Phenol, 2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]- is C15H12N2O3.
The molecular weight of Phenol, 2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]- is 268.08478 g/mol.
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