TL;DR: 2-(4'-Methyl-[2,2'-bipyridin]-4-yl)acetic acid (CAS 118724-25-7) is a chemical compound with molecular formula C13H12N2O2 and molecular weight 228.08987 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[2-(4-methyl-2-pyridinyl)-4-pyridinyl]acetic acid
Also Known As: 4'-Methyl-2,2'-bipyridine-4-acetic acid, J2.004.653H, 2-(4-Methyl-2-pyridyl)pyridine-4-acetic acid, 4 -Methyl-2,2 -bipyridine-4-acetic acid, 2-(4'-Methyl-[2,2'-bipyridin]-4-yl)acetic acid
| Molecular Formula | C13H12N2O2 |
| Molecular Weight | 228.08987 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 63.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.08987 Da |
| Heavy Atoms | 17 |
| Complexity | 270.0 |
| SMILES | CC1=CC(=NC=C1)C2=NC=CC(=C2)CC(=O)O |
| InChIKey | XUMIMXWSFRVKEX-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4'-Methyl-[2,2'-bipyridin]-4-yl)acetic acid. The TPSA of 63.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4'-Methyl-[2,2'-bipyridin]-4-yl)acetic acid. Following Lipinski's Rule of Five, 2-(4'-Methyl-[2,2'-bipyridin]-4-yl)acetic acid has 1 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 2-(4'-Methyl-[2,2'-bipyridin]-4-yl)acetic acid is 118724-25-7.
The molecular formula of 2-(4'-Methyl-[2,2'-bipyridin]-4-yl)acetic acid is C13H12N2O2.
The molecular weight of 2-(4'-Methyl-[2,2'-bipyridin]-4-yl)acetic acid is 228.08987 g/mol.
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