3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid
TL;DR: 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid (CAS 1008068-79-8) is a chemical compound with molecular formula C16H17NO6 and molecular weight 319.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-[[2-(2-oxochromen-7-yl)oxyacetyl]amino]butanoic acid
Also Known As: N-{[(2-oxo-2H-chromen-7-yl)oxy]acetyl}valine, 3-methyl-2-[[2-(2-oxochromen-7-yl)oxyacetyl]amino]butanoic Acid, 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid
| Molecular Formula | C16H17NO6 |
|---|---|
| Molecular Weight | 319.11 g/mol |
| LogP | 1.3972 |
| Topological Polar Surface Area | 105.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 319.1056 |
| Heavy Atoms | 23 |
| Complexity | 779.47925 |
Chemical Identifiers
| CAS Number | 1008068-79-8 |
|---|---|
| SMILES | CC(C)C(C(=O)O)NC(=O)COC1=CC2=C(C=C1)C=CC(=O)O2 |
Product Overview
3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid (CAS 1008068-79-8), with molecular formula C16H17NO6 and molecular weight 319.11 g/mol. IUPAC: 3-methyl-2-[[2-(2-oxochromen-7-yl)oxyacetyl]amino]butanoic acid.
Chemical Property Profile of 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid
Property Insights of 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid
The XLogP value of 1.3972 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid. The TPSA of 105.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid. Following Lipinski's Rule of Five, 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid has 2 hydrogen bond donor(s) and 5 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-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid?
The CAS number of 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid is 1008068-79-8.
What is the molecular formula of 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid?
The molecular formula of 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid is C16H17NO6.
What is the molecular weight of 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid?
The molecular weight of 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid is 319.11 g/mol.
Where can I buy 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid?
You can request a quote for 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-2-(2-((2-oxo-2H-chromen-7-yl)oxy)acetamido)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.