![4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid structure](/static/products/4319/431997-34-1.webp)
4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid
TL;DR: 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid (CAS 431997-34-1) is a chemical compound with molecular formula C17H10Cl2N2O3 and molecular weight 360.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dichloro-2-(quinolin-8-ylcarbamoyl)benzoic acid
Also Known As: 4,5-dichloro-2-(quinolin-8-ylcarbamoyl)benzoic acid, 4,5-Dichloro-N-quinolin-8-yl-phthalamic acid, 4,5-dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid, BAS 06809194, 4,5-dichloro-2-(8-quinolylcarbamoyl)benzoic acid
| Molecular Formula | C17H10Cl2N2O3 |
|---|---|
| Molecular Weight | 360.01 g/mol |
| LogP | 4.4921 |
| Topological Polar Surface Area | 79.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 360.00684 |
| Heavy Atoms | 24 |
| Complexity | 967.9569 |
Chemical Identifiers
| CAS Number | 431997-34-1 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)NC(=O)C3=CC(=C(C=C3C(=O)O)Cl)Cl)N=CC=C2 |
Product Overview
4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid (CAS 431997-34-1), with molecular formula C17H10Cl2N2O3 and molecular weight 360.01 g/mol. IUPAC: 4,5-dichloro-2-(quinolin-8-ylcarbamoyl)benzoic acid.
Chemical Property Profile of 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid
Property Insights of 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid
The XLogP value of 4.4921 indicates that 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.29 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid. Following Lipinski's Rule of Five, 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid has 2 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 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid?
The CAS number of 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid is 431997-34-1.
What is the molecular formula of 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid?
The molecular formula of 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid is C17H10Cl2N2O3.
What is the molecular weight of 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid?
The molecular weight of 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid is 360.01 g/mol.
Where can I buy 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid?
You can request a quote for 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dichloro-2-[oxo-(8-quinolinylamino)methyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.