TL;DR: 2-[(6-Methyl-2-phenyl-4-pyrimidinyl)oxy]propanoic acid (CAS 861212-19-3) is a chemical compound with molecular formula C14H14N2O3 and molecular weight 258.10043 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(6-methyl-2-phenylpyrimidin-4-yl)oxypropanoic acid
Also Known As: 2-[(6-methyl-2-phenyl-4-pyrimidinyl)oxy]propanoic acid, 2-[(6-methyl-2-phenylpyrimidin-4-yl)oxy]propanoic acid, 3K-603S, 2-(6-methyl-2-phenylpyrimidin-4-yl)oxypropanoic acid, 2-(6-methyl-2-phenyl-pyrimidin-4-yl)oxypropanoic Acid
| Molecular Formula | C14H14N2O3 |
| Molecular Weight | 258.10043 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 72.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.10043 Da |
| Heavy Atoms | 19 |
| Complexity | 305.0 |
| SMILES | CC1=CC(=NC(=N1)C2=CC=CC=C2)OC(C)C(=O)O |
| InChIKey | MPBCOLDQMXNXFC-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(6-Methyl-2-phenyl-4-pyrimidinyl)oxy]propanoic acid. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(6-Methyl-2-phenyl-4-pyrimidinyl)oxy]propanoic acid. Following Lipinski's Rule of Five, 2-[(6-Methyl-2-phenyl-4-pyrimidinyl)oxy]propanoic acid 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-[(6-Methyl-2-phenyl-4-pyrimidinyl)oxy]propanoic acid is 861212-19-3.
The molecular formula of 2-[(6-Methyl-2-phenyl-4-pyrimidinyl)oxy]propanoic acid is C14H14N2O3.
The molecular weight of 2-[(6-Methyl-2-phenyl-4-pyrimidinyl)oxy]propanoic acid is 258.10043 g/mol.
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