ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate
TL;DR: ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate (CAS 57721-89-8) is a chemical compound with molecular formula C14H14N2O3 and molecular weight 258.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate
Also Known As: ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate, J1.421.265E, Ethyl 2-cyano-6-methoxy-1,2-dihydroquinolinecarboxylate, Ethyl 2-cyano-6-methoxyquinoline-1(2H)-carboxylate, Ethyl 2-cyano-6-methoxy-1,2-dihydro-1-quinolinecarboxylate
| Molecular Formula | C14H14N2O3 |
|---|---|
| Molecular Weight | 258.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.10043 |
| Heavy Atoms | 19 |
| Complexity | 412.0 |
Chemical Identifiers
| CAS Number | 57721-89-8 |
|---|---|
| SMILES | CCOC(=O)N1C(C=CC2=C1C=CC(=C2)OC)C#N |
| InChIKey | QVVJUKVZDBCDST-UHFFFAOYSA-N |
Product Overview
ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate (CAS 57721-89-8), with molecular formula C14H14N2O3 and molecular weight 258.10 g/mol. IUPAC: ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate.
Chemical Property Profile of ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate
Property Insights of ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate. Following Lipinski's Rule of Five, ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate has 0 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-cyano-6-methoxy-2H-quinoline-1-carboxylate?
The CAS number of ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate is 57721-89-8.
What is the molecular formula of ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate?
The molecular formula of ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate is C14H14N2O3.
What is the molecular weight of ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate?
The molecular weight of ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate is 258.10 g/mol.
Where can I buy ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate?
You can request a quote for ethyl 2-cyano-6-methoxy-2H-quinoline-1-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-cyano-6-methoxy-2H-quinoline-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-cyano-6-methoxy-2H-quinoline-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.