![4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid structure](/static/products/1164/1164530-40-8.webp)
4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid
TL;DR: 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid (CAS 1164530-40-8) is a chemical compound with molecular formula C14H10ClNO4 and molecular weight 291.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoic acid
Also Known As: 4-chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid, AN-979/13514002, (E)-4-chloro-2-(3-(furan-2-yl)acrylamido)benzoic acid, 4-chloro-2-[[(E)-3-(2-furyl)acryloyl]amino]benzoic acid, 4-chloro-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoic acid
| Molecular Formula | C14H10ClNO4 |
|---|---|
| Molecular Weight | 291.03 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 79.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.02985 |
| Heavy Atoms | 20 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 1164530-40-8 |
|---|---|
| SMILES | C1=COC(=C1)/C=C/C(=O)NC2=C(C=CC(=C2)Cl)C(=O)O |
| InChIKey | NEJHSZBHFANDPO-GQCTYLIASA-N |
Product Overview
4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid (CAS 1164530-40-8), with molecular formula C14H10ClNO4 and molecular weight 291.03 g/mol. IUPAC: 4-chloro-2-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]benzoic acid.
Chemical Property Profile of 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid
Property Insights of 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid
The XLogP value of 3.0 indicates that 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid. Following Lipinski's Rule of Five, 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid has 2 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 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid?
The CAS number of 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid is 1164530-40-8.
What is the molecular formula of 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid?
The molecular formula of 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid is C14H10ClNO4.
What is the molecular weight of 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid?
The molecular weight of 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid is 291.03 g/mol.
Where can I buy 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid?
You can request a quote for 4-Chloro-2-{[3-(2-furyl)acryloyl]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 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-{[3-(2-furyl)acryloyl]amino}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.