TL;DR: 3,4-Pyridinedicarboxylic acid, 6-amino-2-methoxy-, dimethyl ester (CAS 149726-21-6) is a chemical compound with molecular formula C10H12N2O5 and molecular weight 240.07462 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl 6-amino-2-methoxypyridine-3,4-dicarboxylate
Also Known As: 2-amino-4,5-dicarbomethoxy-6-methoxypyridine, 3,4-Pyridinedicarboxylic acid, 6-amino-2-methoxy-, dimethyl ester, dimethyl 6-amino-2-methoxypyridine-3,4-dicarboxylate, 2-amino-6-methoxy-4,5-di(methoxycarbonyl)pyridine, Dimethyl 6-amino-2-methoxy-pyridine-3,4-dicarboxylate
| Molecular Formula | C10H12N2O5 |
| Molecular Weight | 240.07462 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 240.07462 Da |
| Heavy Atoms | 17 |
| Complexity | 296.0 |
| SMILES | COC1=C(C(=CC(=N1)N)C(=O)OC)C(=O)OC |
| InChIKey | FXJMTBSGFQBKSY-UHFFFAOYSA-N |
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Pyridinedicarboxylic acid, 6-amino-2-methoxy-, dimethyl ester. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Pyridinedicarboxylic acid, 6-amino-2-methoxy-, dimethyl ester. Following Lipinski's Rule of Five, 3,4-Pyridinedicarboxylic acid, 6-amino-2-methoxy-, dimethyl ester has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3,4-Pyridinedicarboxylic acid, 6-amino-2-methoxy-, dimethyl ester is 149726-21-6.
The molecular formula of 3,4-Pyridinedicarboxylic acid, 6-amino-2-methoxy-, dimethyl ester is C10H12N2O5.
The molecular weight of 3,4-Pyridinedicarboxylic acid, 6-amino-2-methoxy-, dimethyl ester is 240.07462 g/mol.
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