![3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid structure](/static/products/4406/440646-76-4.webp)
3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid
TL;DR: 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid (CAS 440646-76-4) is a chemical compound with molecular formula C14H20N2O5S and molecular weight 328.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-acetamidophenyl)sulfonylamino]-4-methylpentanoic acid
Also Known As: 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid, 3-[(4-acetamidophenyl)sulfonylamino]-4-methylpentanoic acid, 3-({[4-(Acetylamino)phenyl]sulfonyl}-amino)-4-methylpentanoic acid, pentanoic acid, 3-[[[4-(acetylamino)phenyl]sulfonyl]amino]-4-methyl-, 3-[(4-acetamidophenyl)sulfonylamino]-4-methyl-pentanoic Acid
| Molecular Formula | C14H20N2O5S |
|---|---|
| Molecular Weight | 328.11 g/mol |
| LogP | 1.4226 |
| Topological Polar Surface Area | 112.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 328.10928 |
| Heavy Atoms | 22 |
| Complexity | 637.70197 |
Chemical Identifiers
| CAS Number | 440646-76-4 |
|---|---|
| SMILES | CC(C)C(CC(=O)O)NS(=O)(=O)C1=CC=C(C=C1)NC(=O)C |
Product Overview
3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid (CAS 440646-76-4), with molecular formula C14H20N2O5S and molecular weight 328.11 g/mol. IUPAC: 3-[(4-acetamidophenyl)sulfonylamino]-4-methylpentanoic acid.
Chemical Property Profile of 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid
Property Insights of 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid
The XLogP value of 1.4226 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid. The TPSA of 112.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid. Following Lipinski's Rule of Five, 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic 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 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid?
The CAS number of 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid is 440646-76-4.
What is the molecular formula of 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid?
The molecular formula of 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid is C14H20N2O5S.
What is the molecular weight of 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid?
The molecular weight of 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid is 328.11 g/mol.
Where can I buy 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid?
You can request a quote for 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-({[4-(Acetylamino)phenyl]sulfonyl}amino)-4-methylpentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.