![3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid structure](/static/products/1967/196700-63-7.webp)
3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid
TL;DR: 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid (CAS 196700-63-7) is a chemical compound with molecular formula C16H15ClN2O5 and molecular weight 350.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(5-chloro-2,4-dimethoxyphenyl)carbamoylamino]benzoic acid
Also Known As: 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid, 3-[(5-chloro-2,4-dimethoxyphenyl)carbamoylamino]benzoic acid, 3-{[(5-Chloro-2,4-dimethoxyphenyl)carbamoyl]amino}benzoic acid
| Molecular Formula | C16H15ClN2O5 |
|---|---|
| Molecular Weight | 350.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 96.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 350.06696 |
| Heavy Atoms | 24 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 196700-63-7 |
|---|---|
| SMILES | COC1=CC(=C(C=C1NC(=O)NC2=CC=CC(=C2)C(=O)O)Cl)OC |
| InChIKey | BQPARGPDUOLVQJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid (CAS 196700-63-7), with molecular formula C16H15ClN2O5 and molecular weight 350.07 g/mol. IUPAC: 3-[(5-chloro-2,4-dimethoxyphenyl)carbamoylamino]benzoic acid.
Chemical Property Profile of 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid
Property Insights of 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid. The TPSA of 96.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid. Following Lipinski's Rule of Five, 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid has 3 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 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid?
The CAS number of 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid is 196700-63-7.
What is the molecular formula of 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid?
The molecular formula of 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid is C16H15ClN2O5.
What is the molecular weight of 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid?
The molecular weight of 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid is 350.07 g/mol.
Where can I buy 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid?
You can request a quote for 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[[[(5-Chloro-2,4-dimethoxyphenyl)amino]carbonyl]amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.