Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate
TL;DR: Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate (CAS 80812-55-1) is a chemical compound with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methyl-5-oxo-6H-1,6-naphthyridine-3-carboxylate
Also Known As: ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate, ethyl 2-methyl-5-oxo-5,6-dihydro[1,6]naphthyridine-3-carboxylate, ethyl 2-methyl-5-oxo-6H-1,6-naphthyridine-3-carboxylate, 5,6-dihydro-2-methyl-5-oxo-1,6-Naphthyridine-3-carboxylic acid ethyl ester, ethyl2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate
| Molecular Formula | C12H12N2O3 |
|---|---|
| Molecular Weight | 232.08 g/mol |
| LogP | 1.40822 |
| Topological Polar Surface Area | 72.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.0848 |
| Heavy Atoms | 17 |
| Complexity | 631.1736 |
Chemical Identifiers
| CAS Number | 80812-55-1 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2C=CNC(=O)C2=C1)C |
Product Overview
Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate (CAS 80812-55-1), with molecular formula C12H12N2O3 and molecular weight 232.08 g/mol. IUPAC: ethyl 2-methyl-5-oxo-6H-1,6-naphthyridine-3-carboxylate.
Chemical Property Profile of Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate
Property Insights of Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate
The XLogP value of 1.40822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate. The TPSA of 72.05 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate?
The CAS number of Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate is 80812-55-1.
What is the molecular formula of Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate?
The molecular formula of Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate is C12H12N2O3.
What is the molecular weight of Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate?
The molecular weight of Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate is 232.08 g/mol.
Where can I buy Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate?
You can request a quote for Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-methyl-5-oxo-5,6-dihydro-1,6-naphthyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.