TL;DR: 4-[5-(2,5-Dichlorophenyl)-1,2,4-oxadiazol-3-yl]pyridine (CAS 694448-21-0) is a chemical compound with molecular formula C13H7Cl2N3O and molecular weight 290.9966 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(2,5-dichlorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole
Also Known As: 4-[5-(2,5-dichlorophenyl)-1,2,4-oxadiazol-3-yl]pyridine, 5-(2,5-dichlorophenyl)-3-pyridin-4-yl-1,2,4-oxadiazole, 5-(2,5-dichlorophenyl)-3-(4-pyridyl)-1,2,4-oxadiazole, 5-[2,5-bis(chloranyl)phenyl]-3-pyridin-4-yl-1,2,4-oxadiazole
| Molecular Formula | C13H7Cl2N3O |
| Molecular Weight | 290.9966 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.9966 Da |
| Heavy Atoms | 19 |
| Complexity | 302.0 |
| SMILES | C1=CC(=C(C=C1Cl)C2=NC(=NO2)C3=CC=NC=C3)Cl |
| InChIKey | DFDLDCDDFJTFJP-UHFFFAOYSA-N |
The XLogP value of 3.6 indicates that 4-[5-(2,5-Dichlorophenyl)-1,2,4-oxadiazol-3-yl]pyridine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 4-[5-(2,5-Dichlorophenyl)-1,2,4-oxadiazol-3-yl]pyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[5-(2,5-Dichlorophenyl)-1,2,4-oxadiazol-3-yl]pyridine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 4-[5-(2,5-Dichlorophenyl)-1,2,4-oxadiazol-3-yl]pyridine is 694448-21-0.
The molecular formula of 4-[5-(2,5-Dichlorophenyl)-1,2,4-oxadiazol-3-yl]pyridine is C13H7Cl2N3O.
The molecular weight of 4-[5-(2,5-Dichlorophenyl)-1,2,4-oxadiazol-3-yl]pyridine is 290.9966 g/mol.
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