4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid
TL;DR: 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid (CAS 385405-66-3) is a chemical compound with molecular formula C16H22N2O4 and molecular weight 306.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2,3-dimethylanilino)-2-morpholin-4-yl-4-oxobutanoic acid
Also Known As: 4-((2,3-dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid, 4-(2,3-dimethylanilino)-2-morpholin-4-yl-4-oxobutanoic acid, AF-399/15539010, F1124-0066, 3-[(2,3-dimethylphenyl)carbamoyl]-2-morpholin-4-yl-propanoic Acid
| Molecular Formula | C16H22N2O4 |
|---|---|
| Molecular Weight | 306.16 g/mol |
| LogP | 1.41744 |
| Topological Polar Surface Area | 78.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 306.15796 |
| Heavy Atoms | 22 |
| Complexity | 553.07684 |
Chemical Identifiers
| CAS Number | 385405-66-3 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=O)CC(C(=O)O)N2CCOCC2)C |
Product Overview
4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid (CAS 385405-66-3), with molecular formula C16H22N2O4 and molecular weight 306.16 g/mol. IUPAC: 4-(2,3-dimethylanilino)-2-morpholin-4-yl-4-oxobutanoic acid.
Chemical Property Profile of 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid
Property Insights of 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid
The XLogP value of 1.41744 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid. The TPSA of 78.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid has 2 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-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid?
The CAS number of 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid is 385405-66-3.
What is the molecular formula of 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid?
The molecular formula of 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid is C16H22N2O4.
What is the molecular weight of 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid?
The molecular weight of 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid is 306.16 g/mol.
Where can I buy 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid?
You can request a quote for 4-((2,3-Dimethylphenyl)amino)-2-morpholino-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-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-((2,3-Dimethylphenyl)amino)-2-morpholino-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.