diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate
TL;DR: diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate (CAS 1501-73-1) is a chemical compound with molecular formula C17H20N2O5 and molecular weight 332.1372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate
Also Known As: 2-(3, DIETHYL ESTER, diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate, Diethyl 2-(3-oxo-3,4-dihydroquinoxalin-2-yl)pentanedioate
Technical Specifications
| Molecular Formula | C17H20N2O5 |
| Molecular Weight | 332.1372 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 94.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 332.1372 Da |
| Heavy Atoms | 24 |
| Complexity | 517.0 |
| SMILES | CCOC(=O)CCC(C1=NC2=CC=CC=C2NC1=O)C(=O)OCC |
| InChIKey | XUIFHSKWMXEJFV-UHFFFAOYSA-N |
Chemical Property Profile of diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate
Property Insights of diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate. The TPSA of 94.1 Ų falls within the moderate polarity range, balancing permeability and solubility for diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate. Following Lipinski's Rule of Five, diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate?
The CAS number of diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate is 1501-73-1.
What is the molecular formula of diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate?
The molecular formula of diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate is C17H20N2O5.
What is the molecular weight of diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate?
The molecular weight of diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate is 332.1372 g/mol.
Where can I buy diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate?
You can request a quote for diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate?
Yes, CoreyChem provides custom synthesis services for diethyl 2-(3-oxo-4H-quinoxalin-2-yl)pentanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.