(Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one
TL;DR: (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one (CAS 896596-86-4) is a chemical compound with molecular formula C23H26BrNO6 and molecular weight 491.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-7-[[bis(2-methoxyethyl)amino]methyl]-2-[(5-bromo-2-methoxyphenyl)methylidene]-6-hydroxy-1-benzofuran-3-one
Also Known As: (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one, F3385-2642, (2Z)-7-[[bis(2-methoxyethyl)amino]methyl]-2-[(5-bromo-2-methoxyphenyl)methylidene]-6-hydroxy-1-benzofuran-3-one, (2Z)-7-{[bis(2-methoxyethyl)amino]methyl}-2-[(5-bromo-2-methoxyphenyl)methylidene]-6-hydroxy-2,3-dihydro-1-benzofuran-3-one, (2Z)-7-{[bis(2-methoxyethyl)amino]methyl}-2-(5-bromo-2-methoxybenzylidene)-6-hydroxy-1-benzofuran-3(2H)-one
| Molecular Formula | C23H26BrNO6 |
|---|---|
| Molecular Weight | 491.09 g/mol |
| LogP | 3.8743 |
| Topological Polar Surface Area | 77.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 491.09436 |
| Heavy Atoms | 31 |
| Complexity | 966.7793 |
Chemical Identifiers
| CAS Number | 896596-86-4 |
|---|---|
| SMILES | COCCN(CCOC)CC1=C(C=CC2=C1O/C(=C\C3=C(C=CC(=C3)Br)OC)/C2=O)O |
Product Overview
(Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one (CAS 896596-86-4), with molecular formula C23H26BrNO6 and molecular weight 491.09 g/mol. IUPAC: (2Z)-7-[[bis(2-methoxyethyl)amino]methyl]-2-[(5-bromo-2-methoxyphenyl)methylidene]-6-hydroxy-1-benzofuran-3-one.
Chemical Property Profile of (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one
Property Insights of (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one
The XLogP value of 3.8743 indicates that (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.46 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one. Following Lipinski's Rule of Five, (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one has 1 hydrogen bond donor(s) and 7 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)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one?
The CAS number of (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one is 896596-86-4.
What is the molecular formula of (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one?
The molecular formula of (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one is C23H26BrNO6.
What is the molecular weight of (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one?
The molecular weight of (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one is 491.09 g/mol.
Where can I buy (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one?
You can request a quote for (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for (Z)-7-((bis(2-methoxyethyl)amino)methyl)-2-(5-bromo-2-methoxybenzylidene)-6-hydroxybenzofuran-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.