![2-Benzoylbenzo[b]thiophen-3-yl benzoate structure](/static/products/1146/114662-67-8.webp)
2-Benzoylbenzo[b]thiophen-3-yl benzoate
TL;DR: 2-Benzoylbenzo[b]thiophen-3-yl benzoate (CAS 114662-67-8) is a chemical compound with molecular formula C22H14O3S and molecular weight 358.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-benzoyl-1-benzothiophen-3-yl) benzoate
Also Known As: 2-benzoylbenzo[b]thiophen-3-yl benzoate, (2-benzoyl-1-benzothiophen-3-yl) benzoate, 2-BENZOYL-1-BENZOTHIOPHEN-3-YL BENZOATE, 2-(phenylcarbonyl)-1-benzothiophen-3-yl benzoate
| Molecular Formula | C22H14O3S |
|---|---|
| Molecular Weight | 358.07 g/mol |
| LogP | 5.3515 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 358.06638 |
| Heavy Atoms | 26 |
| Complexity | 1082.2983 |
Chemical Identifiers
| CAS Number | 114662-67-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3S2)OC(=O)C4=CC=CC=C4 |
Product Overview
2-Benzoylbenzo[b]thiophen-3-yl benzoate (CAS 114662-67-8), with molecular formula C22H14O3S and molecular weight 358.07 g/mol. IUPAC: (2-benzoyl-1-benzothiophen-3-yl) benzoate.
Chemical Property Profile of 2-Benzoylbenzo[b]thiophen-3-yl benzoate
Property Insights of 2-Benzoylbenzo[b]thiophen-3-yl benzoate
The XLogP value of 5.3515 indicates that 2-Benzoylbenzo[b]thiophen-3-yl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, 2-Benzoylbenzo[b]thiophen-3-yl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzoylbenzo[b]thiophen-3-yl benzoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Benzoylbenzo[b]thiophen-3-yl benzoate?
The CAS number of 2-Benzoylbenzo[b]thiophen-3-yl benzoate is 114662-67-8.
What is the molecular formula of 2-Benzoylbenzo[b]thiophen-3-yl benzoate?
The molecular formula of 2-Benzoylbenzo[b]thiophen-3-yl benzoate is C22H14O3S.
What is the molecular weight of 2-Benzoylbenzo[b]thiophen-3-yl benzoate?
The molecular weight of 2-Benzoylbenzo[b]thiophen-3-yl benzoate is 358.07 g/mol.
Where can I buy 2-Benzoylbenzo[b]thiophen-3-yl benzoate?
You can request a quote for 2-Benzoylbenzo[b]thiophen-3-yl benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzoylbenzo[b]thiophen-3-yl benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzoylbenzo[b]thiophen-3-yl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.