4-Chloro-2-(furan-2-ylmethylamino)benzoic acid
TL;DR: 4-Chloro-2-(furan-2-ylmethylamino)benzoic acid (CAS 74793-12-7) is a chemical compound with molecular formula C12H10ClNO3 and molecular weight 251.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-2-(furan-2-ylmethylamino)benzoic acid
Also Known As: Furosemide Impurity 12, Furosemide Impurity 30, Furosemide Impurity 36, Furosemide Impurity 11, 4-chloro-2-(furan-2-ylmethylamino)benzoic acid
| Molecular Formula | C12H10ClNO3 |
|---|---|
| Molecular Weight | 251.03 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 62.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.03493 |
| Heavy Atoms | 17 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 74793-12-7 |
|---|---|
| SMILES | C1=COC(=C1)CNC2=C(C=CC(=C2)Cl)C(=O)O |
| InChIKey | SYXJAVQYZFWRFS-UHFFFAOYSA-N |
Product Overview
4-Chloro-2-(furan-2-ylmethylamino)benzoic acid (CAS 74793-12-7), with molecular formula C12H10ClNO3 and molecular weight 251.03 g/mol. IUPAC: 4-chloro-2-(furan-2-ylmethylamino)benzoic acid.
Chemical Property Profile of 4-Chloro-2-(furan-2-ylmethylamino)benzoic acid
Property Insights of 4-Chloro-2-(furan-2-ylmethylamino)benzoic acid
The XLogP value of 3.5 indicates that 4-Chloro-2-(furan-2-ylmethylamino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Chloro-2-(furan-2-ylmethylamino)benzoic acid. Following Lipinski's Rule of Five, 4-Chloro-2-(furan-2-ylmethylamino)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-(furan-2-ylmethylamino)benzoic acid?
The CAS number of 4-Chloro-2-(furan-2-ylmethylamino)benzoic acid is 74793-12-7.
What is the molecular formula of 4-Chloro-2-(furan-2-ylmethylamino)benzoic acid?
The molecular formula of 4-Chloro-2-(furan-2-ylmethylamino)benzoic acid is C12H10ClNO3.
What is the molecular weight of 4-Chloro-2-(furan-2-ylmethylamino)benzoic acid?
The molecular weight of 4-Chloro-2-(furan-2-ylmethylamino)benzoic acid is 251.03 g/mol.
Where can I buy 4-Chloro-2-(furan-2-ylmethylamino)benzoic acid?
You can request a quote for 4-Chloro-2-(furan-2-ylmethylamino)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-(furan-2-ylmethylamino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-2-(furan-2-ylmethylamino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.