2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate
TL;DR: 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate (CAS 714233-06-4) is a chemical compound with molecular formula C24H17NO8 and molecular weight 447.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2Z)-2-[(2,4-dimethoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 3-nitrobenzoate
Also Known As: (Z)-2-(2,4-dimethoxybenzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 3-nitrobenzoate, (2Z)-2-(2,4-dimethoxybenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 3-nitrobenzoate, [(2Z)-2-[(2,4-dimethoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 3-nitrobenzoate, [2-[(2,4-dimethoxyphenyl)methylidene]-3-oxo-benzofuran-6-yl] 3-nitrobenzoate, 2-[(2,4-dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate
| Molecular Formula | C24H17NO8 |
|---|---|
| Molecular Weight | 447.10 g/mol |
| LogP | 4.4474 |
| Topological Polar Surface Area | 114.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 447.09543 |
| Heavy Atoms | 33 |
| Complexity | 1311.5664 |
Chemical Identifiers
| CAS Number | 714233-06-4 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC(=CC=C4)[N+](=O)[O-])OC |
Product Overview
2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate (CAS 714233-06-4), with molecular formula C24H17NO8 and molecular weight 447.10 g/mol. IUPAC: [(2Z)-2-[(2,4-dimethoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 3-nitrobenzoate.
Chemical Property Profile of 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate
Property Insights of 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate
The XLogP value of 4.4474 indicates that 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate. Following Lipinski's Rule of Five, 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate has 0 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 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate?
The CAS number of 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate is 714233-06-4.
What is the molecular formula of 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate?
The molecular formula of 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate is C24H17NO8.
What is the molecular weight of 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate?
The molecular weight of 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate is 447.10 g/mol.
Where can I buy 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate?
You can request a quote for 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2,4-Dimethoxyphenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 3-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.