![4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine structure](/static/products/121/1214074-57-3.png)
4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine
TL;DR: 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine (CAS 1214074-57-3) is a chemical compound with molecular formula C22H20ClNO6 and molecular weight 429.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-2-[[2-(3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid
Also Known As: AO-022/43453808, 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine, 3-(4-chlorophenyl)-2-(2-((3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy)acetamido)propanoic acid, 3-(4-chlorophenyl)-2-[[2-(3,4-dimethyl-2-oxo-chromen-7-yl)oxyacetyl]amino]propanoic Acid, 3-(4-chlorophenyl)-2-[[2-(3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid
| Molecular Formula | C22H20ClNO6 |
|---|---|
| Molecular Weight | 429.10 g/mol |
| LogP | 3.25414 |
| Topological Polar Surface Area | 105.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 429.0979 |
| Heavy Atoms | 30 |
| Complexity | 1152.7418 |
Chemical Identifiers
| CAS Number | 1214074-57-3 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O)C |
Product Overview
4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine (CAS 1214074-57-3), with molecular formula C22H20ClNO6 and molecular weight 429.10 g/mol. IUPAC: 3-(4-chlorophenyl)-2-[[2-(3,4-dimethyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid.
Chemical Property Profile of 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine
Property Insights of 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine
The XLogP value of 3.25414 indicates that 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine 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 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine. Following Lipinski's Rule of Five, 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine 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 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine?
The CAS number of 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine is 1214074-57-3.
What is the molecular formula of 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine?
The molecular formula of 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine is C22H20ClNO6.
What is the molecular weight of 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine?
The molecular weight of 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine is 429.10 g/mol.
Where can I buy 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine?
You can request a quote for 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine?
Yes, KEHONG BIO provides custom synthesis services for 4-chloro-N-{[(3,4-dimethyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.