TL;DR: methyl N-(pyridin-2-ylcarbonyl)threoninate (CAS 1008954-94-6) is a chemical compound with molecular formula C11H14N2O4 and molecular weight 238.09535 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 3-hydroxy-2-(pyridine-2-carbonylamino)butanoate
Also Known As: methyl N-(pyridin-2-ylcarbonyl)threoninate, methyl 3-hydroxy-2-(picolinamido)butanoate, methyl 3-hydroxy-2-(pyridine-2-carbonylamino)butanoate
| Molecular Formula | C11H14N2O4 |
| Molecular Weight | 238.09535 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 88.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 238.09535 Da |
| Heavy Atoms | 17 |
| Complexity | 283.0 |
| SMILES | CC(C(C(=O)OC)NC(=O)C1=CC=CC=N1)O |
| InChIKey | RCVWUUZRMLFCGO-UHFFFAOYSA-N |
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-(pyridin-2-ylcarbonyl)threoninate. The TPSA of 88.5 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-(pyridin-2-ylcarbonyl)threoninate. Following Lipinski's Rule of Five, methyl N-(pyridin-2-ylcarbonyl)threoninate has 2 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 methyl N-(pyridin-2-ylcarbonyl)threoninate is 1008954-94-6.
The molecular formula of methyl N-(pyridin-2-ylcarbonyl)threoninate is C11H14N2O4.
The molecular weight of methyl N-(pyridin-2-ylcarbonyl)threoninate is 238.09535 g/mol.
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