5-Bromo-2-(pentanoylamino)benzoic acid
TL;DR: 5-Bromo-2-(pentanoylamino)benzoic acid (CAS 405899-79-8) is a chemical compound with molecular formula C12H14BrNO3 and molecular weight 299.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-(pentanoylamino)benzoic acid
Also Known As: 5-bromo-2-(pentanoylamino)benzoic acid, 5-BROMO-2-PENTANAMIDOBENZOIC ACID
| Molecular Formula | C12H14BrNO3 |
|---|---|
| Molecular Weight | 299.02 g/mol |
| LogP | 3.276 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.01572 |
| Heavy Atoms | 17 |
| Complexity | 431.75897 |
Chemical Identifiers
| CAS Number | 405899-79-8 |
|---|---|
| SMILES | CCCCC(=O)NC1=C(C=C(C=C1)Br)C(=O)O |
Product Overview
5-Bromo-2-(pentanoylamino)benzoic acid (CAS 405899-79-8), with molecular formula C12H14BrNO3 and molecular weight 299.02 g/mol. IUPAC: 5-bromo-2-(pentanoylamino)benzoic acid.
Chemical Property Profile of 5-Bromo-2-(pentanoylamino)benzoic acid
Property Insights of 5-Bromo-2-(pentanoylamino)benzoic acid
The XLogP value of 3.276 indicates that 5-Bromo-2-(pentanoylamino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Bromo-2-(pentanoylamino)benzoic acid. Following Lipinski's Rule of Five, 5-Bromo-2-(pentanoylamino)benzoic acid has 2 hydrogen bond donor(s) and 2 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-(pentanoylamino)benzoic acid?
The CAS number of 5-Bromo-2-(pentanoylamino)benzoic acid is 405899-79-8.
What is the molecular formula of 5-Bromo-2-(pentanoylamino)benzoic acid?
The molecular formula of 5-Bromo-2-(pentanoylamino)benzoic acid is C12H14BrNO3.
What is the molecular weight of 5-Bromo-2-(pentanoylamino)benzoic acid?
The molecular weight of 5-Bromo-2-(pentanoylamino)benzoic acid is 299.02 g/mol.
Where can I buy 5-Bromo-2-(pentanoylamino)benzoic acid?
You can request a quote for 5-Bromo-2-(pentanoylamino)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-(pentanoylamino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-2-(pentanoylamino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.