4-Amino-7-chloro-3-cinnolinecarboxylic acid
TL;DR: 4-Amino-7-chloro-3-cinnolinecarboxylic acid (CAS 16205-84-8) is a chemical compound with molecular formula C9H6ClN3O2 and molecular weight 223.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-7-chlorocinnoline-3-carboxylic acid
Also Known As: 4-amino-7-chlorocinnoline-3-carboxylic acid, 3-Cinnolinecarboxylic acid, 4-amino-7-chloro-, 4-Amino-7-chloro-3-cinnolinecarboxylic acid, NCI60_024153, 7-Chloro-4-aminocinnoline-3-carboxylic acid
| Molecular Formula | C9H6ClN3O2 |
|---|---|
| Molecular Weight | 223.01 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 89.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.01485 |
| Heavy Atoms | 15 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 16205-84-8 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)N=NC(=C2N)C(=O)O |
| InChIKey | BADWGFOQGQMHJZ-UHFFFAOYSA-N |
Product Overview
4-Amino-7-chloro-3-cinnolinecarboxylic acid (CAS 16205-84-8), with molecular formula C9H6ClN3O2 and molecular weight 223.01 g/mol. IUPAC: 4-amino-7-chlorocinnoline-3-carboxylic acid.
Chemical Property Profile of 4-Amino-7-chloro-3-cinnolinecarboxylic acid
Property Insights of 4-Amino-7-chloro-3-cinnolinecarboxylic acid
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Amino-7-chloro-3-cinnolinecarboxylic acid. The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-7-chloro-3-cinnolinecarboxylic acid. Following Lipinski's Rule of Five, 4-Amino-7-chloro-3-cinnolinecarboxylic acid has 2 hydrogen bond donor(s) and 5 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 4-Amino-7-chloro-3-cinnolinecarboxylic acid?
The CAS number of 4-Amino-7-chloro-3-cinnolinecarboxylic acid is 16205-84-8.
What is the molecular formula of 4-Amino-7-chloro-3-cinnolinecarboxylic acid?
The molecular formula of 4-Amino-7-chloro-3-cinnolinecarboxylic acid is C9H6ClN3O2.
What is the molecular weight of 4-Amino-7-chloro-3-cinnolinecarboxylic acid?
The molecular weight of 4-Amino-7-chloro-3-cinnolinecarboxylic acid is 223.01 g/mol.
Where can I buy 4-Amino-7-chloro-3-cinnolinecarboxylic acid?
You can request a quote for 4-Amino-7-chloro-3-cinnolinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-7-chloro-3-cinnolinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-7-chloro-3-cinnolinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.