(Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid
TL;DR: (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid (CAS 864761-50-2) is a chemical compound with molecular formula C23H23NO9 and molecular weight 457.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[2-[[(2Z)-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl]oxy]acetyl]amino]propanoic acid
Also Known As: (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid, 3-[[2-[[(2Z)-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl]oxy]acetyl]amino]propanoic acid, 3-[[2-[3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]benzofuran-6-yl]oxyacetyl]amino]propanoic Acid, N-({[(2Z)-3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydro-1-benzofuran-6-yl]oxy}acetyl)-beta-alanine
| Molecular Formula | C23H23NO9 |
|---|---|
| Molecular Weight | 457.14 g/mol |
| LogP | 2.2983 |
| Topological Polar Surface Area | 129.62 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 457.13727 |
| Heavy Atoms | 33 |
| Complexity | 1082.1012 |
Chemical Identifiers
| CAS Number | 864761-50-2 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OCC(=O)NCCC(=O)O |
Product Overview
(Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid (CAS 864761-50-2), with molecular formula C23H23NO9 and molecular weight 457.14 g/mol. IUPAC: 3-[[2-[[(2Z)-3-oxo-2-[(3,4,5-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl]oxy]acetyl]amino]propanoic acid.
Chemical Property Profile of (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid
Property Insights of (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid
The XLogP value of 2.2983 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid. The TPSA of 129.62 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid. Following Lipinski's Rule of Five, (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid has 2 hydrogen bond donor(s) and 8 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 (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid?
The CAS number of (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid is 864761-50-2.
What is the molecular formula of (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid?
The molecular formula of (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid is C23H23NO9.
What is the molecular weight of (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid?
The molecular weight of (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid is 457.14 g/mol.
Where can I buy (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid?
You can request a quote for (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-(2-((3-oxo-2-(3,4,5-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl)oxy)acetamido)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.