![2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate structure](/static/products/622/622795-87-3.png)
2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate
TL;DR: 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate (CAS 622795-87-3) 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-[(4-nitrophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 2,6-dimethoxybenzoate
Also Known As: (2Z)-2-(4-nitrobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl 2,6-dimethoxybenzoate, (Z)-2-(4-nitrobenzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl 2,6-dimethoxybenzoate, [(2Z)-2-[(4-nitrophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 2,6-dimethoxybenzoate, [2-[(4-nitrophenyl)methylidene]-3-oxo-benzofuran-6-yl] 2,6-dimethoxybenzoate, 2-[(4-nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate
| 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 | 1272.0664 |
Chemical Identifiers
| CAS Number | 622795-87-3 |
|---|---|
| SMILES | COC1=C(C(=CC=C1)OC)C(=O)OC2=CC3=C(C=C2)C(=O)/C(=C/C4=CC=C(C=C4)[N+](=O)[O-])/O3 |
Product Overview
2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate (CAS 622795-87-3), with molecular formula C24H17NO8 and molecular weight 447.10 g/mol. IUPAC: [(2Z)-2-[(4-nitrophenyl)methylidene]-3-oxo-1-benzofuran-6-yl] 2,6-dimethoxybenzoate.
Chemical Property Profile of 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate
Property Insights of 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate
The XLogP value of 4.4474 indicates that 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate 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-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate. Following Lipinski's Rule of Five, 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate 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-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate?
The CAS number of 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate is 622795-87-3.
What is the molecular formula of 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate?
The molecular formula of 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate is C24H17NO8.
What is the molecular weight of 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate?
The molecular weight of 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate is 447.10 g/mol.
Where can I buy 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate?
You can request a quote for 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Nitrophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yl 2,6-dimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.