![2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one structure](/static/products/116/1164565-99-4.png)
2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one
TL;DR: 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one (CAS 1164565-99-4) is a chemical compound with molecular formula C14H10OS2 and molecular weight 258.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[(5-methylthiophen-2-yl)methylidene]-1-benzothiophen-3-one
Also Known As: BAS 01095894, 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one, (2Z)-2-[(5-methylthiophen-2-yl)methylidene]-1-benzothiophen-3-one, 2-[(5-methyl-2-thienyl)methylene]-1-benzothiophen-3(2H)-one, 2-[(5-methyl-2-thienyl)methylene]benzo[b]thiophen-3-one
| Molecular Formula | C14H10OS2 |
|---|---|
| Molecular Weight | 258.02 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 70.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.0173 |
| Heavy Atoms | 17 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 1164565-99-4 |
|---|---|
| SMILES | CC1=CC=C(S1)/C=C\2/C(=O)C3=CC=CC=C3S2 |
| InChIKey | GJGVJHSDPXITJE-JYRVWZFOSA-N |
Product Overview
2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one (CAS 1164565-99-4), with molecular formula C14H10OS2 and molecular weight 258.02 g/mol. IUPAC: (2Z)-2-[(5-methylthiophen-2-yl)methylidene]-1-benzothiophen-3-one.
Chemical Property Profile of 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one
Property Insights of 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one
The XLogP value of 4.3 indicates that 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one. Following Lipinski's Rule of Five, 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one has 0 hydrogen bond donor(s) and 3 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 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one?
The CAS number of 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one is 1164565-99-4.
What is the molecular formula of 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one?
The molecular formula of 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one is C14H10OS2.
What is the molecular weight of 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one?
The molecular weight of 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one is 258.02 g/mol.
Where can I buy 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one?
You can request a quote for 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Methyl-thiophen-2-ylmethylene)-benzo[b]thiophen-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.