2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate
TL;DR: 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate (CAS 848916-13-2) is a chemical compound with molecular formula C24H17BrO6 and molecular weight 480.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2Z)-2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 4-bromobenzoate
Also Known As: (Z)-2-(2,5-dimethoxybenzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 4-bromobenzoate, (2Z)-2-(2,5-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 4-bromobenzoate, [(2Z)-2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 4-bromobenzoate, [2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl] 4-bromobenzoate, 2-[(2,5-dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate
| Molecular Formula | C24H17BrO6 |
|---|---|
| Molecular Weight | 480.02 g/mol |
| LogP | 5.3017 |
| Topological Polar Surface Area | 71.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 480.02084 |
| Heavy Atoms | 31 |
| Complexity | 1197.1914 |
Chemical Identifiers
| CAS Number | 848916-13-2 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)OC)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=C(C=C4)Br |
Product Overview
2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate (CAS 848916-13-2), with molecular formula C24H17BrO6 and molecular weight 480.02 g/mol. IUPAC: [(2Z)-2-[(2,5-dimethoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 4-bromobenzoate.
Chemical Property Profile of 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate
Property Insights of 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate
The XLogP value of 5.3017 indicates that 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate. Following Lipinski's Rule of Five, 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate?
The CAS number of 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate is 848916-13-2.
What is the molecular formula of 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate?
The molecular formula of 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate is C24H17BrO6.
What is the molecular weight of 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate?
The molecular weight of 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate is 480.02 g/mol.
Where can I buy 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate?
You can request a quote for 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2,5-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 4-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.