![5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid structure](/static/products/6674/667409-88-3.webp)
5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid
TL;DR: 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid (CAS 667409-88-3) is a chemical compound with molecular formula C12H12BrNO4 and molecular weight 312.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-(oxolane-2-carbonylamino)benzoic acid
Also Known As: 5-bromo-2-(oxolane-2-carbonylamino)benzoic Acid, 5-bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid, 5-BROMO-2-(OXOLANE-2-AMIDO)BENZOIC ACID
| Molecular Formula | C12H12BrNO4 |
|---|---|
| Molecular Weight | 312.99 g/mol |
| LogP | 2.2648 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 312.99496 |
| Heavy Atoms | 18 |
| Complexity | 482.9658 |
Chemical Identifiers
| CAS Number | 667409-88-3 |
|---|---|
| SMILES | C1CC(OC1)C(=O)NC2=C(C=C(C=C2)Br)C(=O)O |
Product Overview
5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid (CAS 667409-88-3), with molecular formula C12H12BrNO4 and molecular weight 312.99 g/mol. IUPAC: 5-bromo-2-(oxolane-2-carbonylamino)benzoic acid.
Chemical Property Profile of 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid
Property Insights of 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid
The XLogP value of 2.2648 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid. Following Lipinski's Rule of Five, 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]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 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid?
The CAS number of 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid is 667409-88-3.
What is the molecular formula of 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid?
The molecular formula of 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid is C12H12BrNO4.
What is the molecular weight of 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid?
The molecular weight of 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid is 312.99 g/mol.
Where can I buy 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid?
You can request a quote for 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)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 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-2-[(tetrahydrofuran-2-ylcarbonyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.