7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate
TL;DR: 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate (CAS 399017-38-0) is a chemical compound with molecular formula C16H10N2O4 and molecular weight 294.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(3-carboxy-2-pyridinyl)quinolizin-5-ium-1-carboxylate
Also Known As: 7-(3-carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate, 7-(3-carboxypyridin-2-yl)quinolizin-5-ium-1-carboxylate, 7-(3-carboxypyridin-2-yl)-5lambda5-quinolizin-5-ylium-1-carboxylate, J1.649.214K, 2-(9-Carboxyquinolizin-5-ium-3-yl)nicotinate
| Molecular Formula | C16H10N2O4 |
|---|---|
| Molecular Weight | 294.06 g/mol |
| LogP | 0.549 |
| Topological Polar Surface Area | 94.42 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.06406 |
| Heavy Atoms | 22 |
| Complexity | 905.5413 |
Chemical Identifiers
| CAS Number | 399017-38-0 |
|---|---|
| SMILES | C1=CC(=C(N=C1)C2=C[N+]3=CC=CC(=C3C=C2)C(=O)[O-])C(=O)O |
Product Overview
7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate (CAS 399017-38-0), with molecular formula C16H10N2O4 and molecular weight 294.06 g/mol. IUPAC: 7-(3-carboxy-2-pyridinyl)quinolizin-5-ium-1-carboxylate.
Chemical Property Profile of 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate
Property Insights of 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate
The XLogP value of 0.549 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate. The TPSA of 94.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate. Following Lipinski's Rule of Five, 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate 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 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate?
The CAS number of 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate is 399017-38-0.
What is the molecular formula of 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate?
The molecular formula of 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate is C16H10N2O4.
What is the molecular weight of 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate?
The molecular weight of 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate is 294.06 g/mol.
Where can I buy 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate?
You can request a quote for 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 7-(3-Carboxy-2-pyridinyl)-1-quinoliziniumcarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.