![4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid structure](/static/products/815/815613-59-3.png)
4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid
TL;DR: 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid (CAS 815613-59-3) is a chemical compound with molecular formula C13H16N2O4 and molecular weight 264.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(dimethylcarbamoyl)anilino]-4-oxobutanoic acid
Also Known As: 4-[2-(dimethylcarbamoyl)anilino]-4-oxobutanoic acid, AN-329/43341737, 4-{2-[(dimethylamino)carbonyl]anilino}-4-oxobutanoic acid, 4-({2-[(dimethylamino)carbonyl]phenyl}amino)-4-oxobutanoic acid, 4-{[2-(dimethylcarbamoyl)phenyl]amino}-4-oxobutanoic acid
| Molecular Formula | C13H16N2O4 |
|---|---|
| Molecular Weight | 264.11 g/mol |
| LogP | 1.1917 |
| Topological Polar Surface Area | 86.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 264.111 |
| Heavy Atoms | 19 |
| Complexity | 497.1715 |
Chemical Identifiers
| CAS Number | 815613-59-3 |
|---|---|
| SMILES | CN(C)C(=O)C1=CC=CC=C1NC(=O)CCC(=O)O |
Product Overview
4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid (CAS 815613-59-3), with molecular formula C13H16N2O4 and molecular weight 264.11 g/mol. IUPAC: 4-[2-(dimethylcarbamoyl)anilino]-4-oxobutanoic acid.
Chemical Property Profile of 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid
Property Insights of 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid
The XLogP value of 1.1917 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid. The TPSA of 86.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic 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 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid?
The CAS number of 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid is 815613-59-3.
What is the molecular formula of 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid?
The molecular formula of 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid is C13H16N2O4.
What is the molecular weight of 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid?
The molecular weight of 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid is 264.11 g/mol.
Where can I buy 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid?
You can request a quote for 4-[2-(Dimethylcarbamoyl)anilino]-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-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[2-(Dimethylcarbamoyl)anilino]-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.