TL;DR: Pyridinium, 1-methyl-4-(5-phenyl-2-oxazolyl)-, chloride (CAS 109495-48-9) is a chemical compound with molecular formula C15H13ClN2O and molecular weight 272.07166 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1-methylpyridin-1-ium-4-yl)-5-phenyl-1,3-oxazole chloride
Also Known As: 1-Methyl-4-(5-phenyl-2-oxazolyl)pyridinium chloride, 323 HC, 4-2-(5-Phenyloxazolyl)-1-methylpyridinium chloride, Pyridinium, 1-methyl-4-(5-phenyl-2-oxazolyl)-, chloride, Pyridinium,1-methyl-4-(5-phenyl-2-oxazolyl)-, chloride (1:1)
| Molecular Formula | C15H13ClN2O |
| Molecular Weight | 272.07166 g/mol |
| XLogP | -0.1629 |
| Topological Polar Surface Area (TPSA) | 29.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.07166 Da |
| Heavy Atoms | 19 |
| Complexity | 257.0 |
| SMILES | C[N+]1=CC=C(C=C1)C2=NC=C(O2)C3=CC=CC=C3.[Cl-] |
| InChIKey | HBHGKGHGFXDXKW-UHFFFAOYSA-M |
The XLogP value of -0.1629 indicates that Pyridinium, 1-methyl-4-(5-phenyl-2-oxazolyl)-, chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 29.9 Ų, Pyridinium, 1-methyl-4-(5-phenyl-2-oxazolyl)-, chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 1-methyl-4-(5-phenyl-2-oxazolyl)-, chloride 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 Pyridinium, 1-methyl-4-(5-phenyl-2-oxazolyl)-, chloride is 109495-48-9.
The molecular formula of Pyridinium, 1-methyl-4-(5-phenyl-2-oxazolyl)-, chloride is C15H13ClN2O.
The molecular weight of Pyridinium, 1-methyl-4-(5-phenyl-2-oxazolyl)-, chloride is 272.07166 g/mol.
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