![1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid structure](/static/products/5008/500868-84-8.webp)
1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid
TL;DR: 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid (CAS 500868-84-8) is a chemical compound with molecular formula C13H15NO2 and molecular weight 217.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-carboxylic acid
Also Known As: 9-julolidinecarboxylic acid, 1,2,3,5,6,7-hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid, J3.791.396K, 1,2,3,5,6,7-hexahydropyrido[3,2,1-ij]quinoline-9-carboxylicacid, 1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-carboxylic acid
| Molecular Formula | C13H15NO2 |
|---|---|
| Molecular Weight | 217.11 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.11028 |
| Heavy Atoms | 16 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 500868-84-8 |
|---|---|
| SMILES | C1CC2=CC(=CC3=C2N(C1)CCC3)C(=O)O |
| InChIKey | DIZIGJGAONLUKP-UHFFFAOYSA-N |
Product Overview
1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid (CAS 500868-84-8), with molecular formula C13H15NO2 and molecular weight 217.11 g/mol. IUPAC: 1-azatricyclo[7.3.1.05,13]trideca-5,7,9(13)-triene-7-carboxylic acid.
Chemical Property Profile of 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid
Property Insights of 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid. With a topological polar surface area (TPSA) of 40.5 Ų, 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid has 1 hydrogen bond donor(s) and 3 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 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid?
The CAS number of 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid is 500868-84-8.
What is the molecular formula of 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid?
The molecular formula of 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid is C13H15NO2.
What is the molecular weight of 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid?
The molecular weight of 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid is 217.11 g/mol.
Where can I buy 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid?
You can request a quote for 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,5,6,7-Hexahydropyrido[3,2,1-ij]quinoline-9-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.