![methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate structure](/static/products/622/622804-90-4.png)
methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate
TL;DR: methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate (CAS 622804-90-4) is a chemical compound with molecular formula C30H22O5 and molecular weight 462.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[[(2Z)-3-oxo-2-[(4-phenylphenyl)methylidene]-1-benzofuran-6-yl]oxymethyl]benzoate
Also Known As: methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate, Methyl 4-[[3-oxo-2-[(4-phenylphenyl)methylidene]benzofuran-6-yl]oxymethyl]benzoate, (Z)-methyl 4-(((2-([1,1'-biphenyl]-4-ylmethylene)-3-oxo-2,3-dihydrobenzofuran-6-yl)oxy)methyl)benzoate, methyl 4-({[(2Z)-2-(biphenyl-4-ylmethylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}methyl)benzoate, methyl 4-[[(2Z)-3-oxo-2-[(4-phenylphenyl)methylidene]-1-benzofuran-6-yl]oxymethyl]benzoate
| Molecular Formula | C30H22O5 |
|---|---|
| Molecular Weight | 462.15 g/mol |
| LogP | 6.3354 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 462.14673 |
| Heavy Atoms | 35 |
| Complexity | 1401.8391 |
Chemical Identifiers
| CAS Number | 622804-90-4 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)COC2=CC3=C(C=C2)C(=O)/C(=C/C4=CC=C(C=C4)C5=CC=CC=C5)/O3 |
Product Overview
methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate (CAS 622804-90-4), with molecular formula C30H22O5 and molecular weight 462.15 g/mol. IUPAC: methyl 4-[[(2Z)-3-oxo-2-[(4-phenylphenyl)methylidene]-1-benzofuran-6-yl]oxymethyl]benzoate.
Chemical Property Profile of methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate
Property Insights of methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate
The XLogP value of 6.3354 indicates that methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate. Following Lipinski's Rule of Five, methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate?
The CAS number of methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate is 622804-90-4.
What is the molecular formula of methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate?
The molecular formula of methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate is C30H22O5.
What is the molecular weight of methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate?
The molecular weight of methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate is 462.15 g/mol.
Where can I buy methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate?
You can request a quote for methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 4-({3-oxo-2-[(4-phenylphenyl)methylene]benzo[3,4-b]furan-6-yloxy}methyl )benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.