2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid
TL;DR: 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid (CAS 1214129-07-3) is a chemical compound with molecular formula C28H24ClNO6 and molecular weight 505.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(3-benzyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(4-chlorophenyl)propanoic acid
Also Known As: 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid, N-{[(3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}-4-chlorophenylalanine, 2-[[2-(3-benzyl-4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]-3-(4-chlorophenyl)propanoic Acid, 2-[[2-(3-benzyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(4-chlorophenyl)propanoic acid
| Molecular Formula | C28H24ClNO6 |
|---|---|
| Molecular Weight | 505.13 g/mol |
| LogP | 4.53652 |
| Topological Polar Surface Area | 105.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 505.1292 |
| Heavy Atoms | 36 |
| Complexity | 1447.1368 |
Chemical Identifiers
| CAS Number | 1214129-07-3 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O)CC4=CC=CC=C4 |
Product Overview
2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid (CAS 1214129-07-3), with molecular formula C28H24ClNO6 and molecular weight 505.13 g/mol. IUPAC: 2-[[2-(3-benzyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(4-chlorophenyl)propanoic acid.
Chemical Property Profile of 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid
Property Insights of 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid
The XLogP value of 4.53652 indicates that 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.84 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid. Following Lipinski's Rule of Five, 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid?
The CAS number of 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid is 1214129-07-3.
What is the molecular formula of 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid?
The molecular formula of 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid is C28H24ClNO6.
What is the molecular weight of 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid?
The molecular weight of 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid is 505.13 g/mol.
Where can I buy 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid?
You can request a quote for 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-((3-benzyl-4-methyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)-3-(4-chlorophenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.