![4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid structure](/static/products/816/816442-95-2.png)
4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid
TL;DR: 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid (CAS 816442-95-2) is a chemical compound with molecular formula C16H21BrN2O5 and molecular weight 400.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-[2-(2-bromo-4-tert-butylphenoxy)acetyl]hydrazinyl]-4-oxobutanoic acid
Also Known As: starbld0029215, 4-{2-[(2-bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid, 4-(2-(2-(2-Bromo-4-(tert-butyl)phenoxy)acetyl)hydrazinyl)-4-oxobutanoic acid, 4-[2-[2-(2-bromo-4-tert-butylphenoxy)acetyl]hydrazinyl]-4-oxobutanoic acid, 3-[[[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]amino]carbamoyl]propanoic Acid
| Molecular Formula | C16H21BrN2O5 |
|---|---|
| Molecular Weight | 400.06 g/mol |
| LogP | 2.1376 |
| Topological Polar Surface Area | 104.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 400.0634 |
| Heavy Atoms | 24 |
| Complexity | 625.38403 |
Chemical Identifiers
| CAS Number | 816442-95-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NNC(=O)CCC(=O)O)Br |
Product Overview
4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid (CAS 816442-95-2), with molecular formula C16H21BrN2O5 and molecular weight 400.06 g/mol. IUPAC: 4-[2-[2-(2-bromo-4-tert-butylphenoxy)acetyl]hydrazinyl]-4-oxobutanoic acid.
Chemical Property Profile of 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid
Property Insights of 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid
The XLogP value of 2.1376 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid. The TPSA of 104.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid has 3 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-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid?
The CAS number of 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid is 816442-95-2.
What is the molecular formula of 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid?
The molecular formula of 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid is C16H21BrN2O5.
What is the molecular weight of 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid?
The molecular weight of 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid is 400.06 g/mol.
Where can I buy 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid?
You can request a quote for 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{2-[(2-Bromo-4-tert-butylphenoxy)acetyl]hydrazino}-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.