![3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate structure](/static/products/7047/7047-82-7.webp)
3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate
TL;DR: 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate (CAS 7047-82-7) is a chemical compound with molecular formula C20H12O4S and molecular weight 348.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] benzoate
Also Known As: [3-oxo-2-(thiophen-2-ylmethylidene)benzofuran-6-yl] Benzoate|3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate|[3-oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] benzoate
| Molecular Formula | C20H12O4S |
|---|---|
| Molecular Weight | 348.05 g/mol |
| LogP | 4.5835 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 348.04562 |
| Heavy Atoms | 25 |
| Complexity | 972.19543 |
Chemical Identifiers
| CAS Number | 7047-82-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC=CS4)O3 |
Product Overview
3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate (CAS 7047-82-7), with molecular formula C20H12O4S and molecular weight 348.05 g/mol. IUPAC: [3-oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] benzoate.
Chemical Property Profile of 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate
Property Insights of 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate
The XLogP value of 4.5835 indicates that 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate has 0 hydrogen bond donor(s) and 5 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 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate?
The CAS number of 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate is 7047-82-7.
What is the molecular formula of 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate?
The molecular formula of 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate is C20H12O4S.
What is the molecular weight of 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate?
The molecular weight of 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate is 348.05 g/mol.
Where can I buy 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate?
You can request a quote for 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate?
Yes, KEHONG BIO provides custom synthesis services for 3-Oxo-2-[(thiophen-2-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.