N-(5-Bromo-2-hydroxybenzoyl)valine
TL;DR: N-(5-Bromo-2-hydroxybenzoyl)valine (CAS 7006-71-5) is a chemical compound with molecular formula C12H14BrNO4 and molecular weight 315.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-bromo-2-hydroxybenzoyl)amino]-3-methylbutanoic acid
Also Known As: N-(5-Bromo-2-hydroxybenzoyl)valine, 2-[(5-bromo-2-hydroxybenzoyl)amino]-3-methylbutanoic acid, 2-[(5-bromo-2-hydroxy-benzoyl)amino]-3-methyl-butanoic Acid
| Molecular Formula | C12H14BrNO4 |
|---|---|
| Molecular Weight | 315.01 g/mol |
| LogP | 1.9937 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 315.01062 |
| Heavy Atoms | 18 |
| Complexity | 473.14526 |
Chemical Identifiers
| CAS Number | 7006-71-5 |
|---|---|
| SMILES | CC(C)C(C(=O)O)NC(=O)C1=C(C=CC(=C1)Br)O |
Product Overview
N-(5-Bromo-2-hydroxybenzoyl)valine (CAS 7006-71-5), with molecular formula C12H14BrNO4 and molecular weight 315.01 g/mol. IUPAC: 2-[(5-bromo-2-hydroxybenzoyl)amino]-3-methylbutanoic acid.
Chemical Property Profile of N-(5-Bromo-2-hydroxybenzoyl)valine
Property Insights of N-(5-Bromo-2-hydroxybenzoyl)valine
The XLogP value of 1.9937 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-Bromo-2-hydroxybenzoyl)valine. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-Bromo-2-hydroxybenzoyl)valine. Following Lipinski's Rule of Five, N-(5-Bromo-2-hydroxybenzoyl)valine has 3 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 N-(5-Bromo-2-hydroxybenzoyl)valine?
The CAS number of N-(5-Bromo-2-hydroxybenzoyl)valine is 7006-71-5.
What is the molecular formula of N-(5-Bromo-2-hydroxybenzoyl)valine?
The molecular formula of N-(5-Bromo-2-hydroxybenzoyl)valine is C12H14BrNO4.
What is the molecular weight of N-(5-Bromo-2-hydroxybenzoyl)valine?
The molecular weight of N-(5-Bromo-2-hydroxybenzoyl)valine is 315.01 g/mol.
Where can I buy N-(5-Bromo-2-hydroxybenzoyl)valine?
You can request a quote for N-(5-Bromo-2-hydroxybenzoyl)valine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(5-Bromo-2-hydroxybenzoyl)valine?
Yes, KEHONG BIO provides custom synthesis services for N-(5-Bromo-2-hydroxybenzoyl)valine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.