![[3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate structure](/static/products/7047/7047-99-6.webp)
[3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate
TL;DR: [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate (CAS 7047-99-6) is a chemical compound with molecular formula C17H13ClO4S and molecular weight 348.02 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] 4-chlorobutanoate
Also Known As: [3-oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate|[3-oxo-2-(thiophen-2-ylmethylidene)benzofuran-6-yl] 4-chlorobutanoate
| Molecular Formula | C17H13ClO4S |
|---|---|
| Molecular Weight | 348.02 g/mol |
| LogP | 4.2887 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 348.0223 |
| Heavy Atoms | 23 |
| Complexity | 764.90546 |
Chemical Identifiers
| CAS Number | 7047-99-6 |
|---|---|
| SMILES | C1=CSC(=C1)C=C2C(=O)C3=C(O2)C=C(C=C3)OC(=O)CCCCl |
Product Overview
[3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate (CAS 7047-99-6), with molecular formula C17H13ClO4S and molecular weight 348.02 g/mol. IUPAC: [3-oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate.
Chemical Property Profile of [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate
Property Insights of [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate
The XLogP value of 4.2887 indicates that [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate 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-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate 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-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate?
The CAS number of [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate is 7047-99-6.
What is the molecular formula of [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate?
The molecular formula of [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate is C17H13ClO4S.
What is the molecular weight of [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate?
The molecular weight of [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate is 348.02 g/mol.
Where can I buy [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate?
You can request a quote for [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate 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-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate?
Yes, KEHONG BIO provides custom synthesis services for [3-Oxo-2-(thiophen-2-ylmethylidene)-1-benzofuran-6-yl] 4-chlorobutanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.