![[4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate structure](/static/products/250/25015-97-8.png)
[4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate
TL;DR: [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate (CAS 25015-97-8) is a chemical compound with molecular formula C17H12O3S and molecular weight 296.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(3-oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate
Also Known As: BAS 00491237, [4-[(3-oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate, 4-[(3-oxo-1-benzothien-2(3H)-ylidene)methyl]phenyl acetate
| Molecular Formula | C17H12O3S |
|---|---|
| Molecular Weight | 296.05 g/mol |
| LogP | 3.9414 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.05072 |
| Heavy Atoms | 21 |
| Complexity | 744.88544 |
Chemical Identifiers
| CAS Number | 25015-97-8 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)C=C2C(=O)C3=CC=CC=C3S2 |
Product Overview
[4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate (CAS 25015-97-8), with molecular formula C17H12O3S and molecular weight 296.05 g/mol. IUPAC: [4-[(3-oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate.
Chemical Property Profile of [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate
Property Insights of [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate
The XLogP value of 3.9414 indicates that [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.37 Ų, [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate has 0 hydrogen bond donor(s) and 4 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 [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate?
The CAS number of [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate is 25015-97-8.
What is the molecular formula of [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate?
The molecular formula of [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate is C17H12O3S.
What is the molecular weight of [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate?
The molecular weight of [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate is 296.05 g/mol.
Where can I buy [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate?
You can request a quote for [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate?
Yes, KEHONG BIO provides custom synthesis services for [4-[(3-Oxo-1-benzothiophen-2-ylidene)methyl]phenyl] acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.