3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one
TL;DR: 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one (CAS 71741-89-4) is a chemical compound with molecular formula C15H12O2S and molecular weight 256.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylidene-5-phenyl-5-thiophen-2-yloxolan-2-one
Also Known As: 3-methylidene-5-phenyl-5-thiophen-2-yloxolan-2-one, 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one
| Molecular Formula | C15H12O2S |
|---|---|
| Molecular Weight | 256.06 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.0558 |
| Heavy Atoms | 18 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 71741-89-4 |
|---|---|
| SMILES | C=C1CC(OC1=O)(C2=CC=CC=C2)C3=CC=CS3 |
| InChIKey | FNQLFWNPOBEWDW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one (CAS 71741-89-4), with molecular formula C15H12O2S and molecular weight 256.06 g/mol. IUPAC: 3-methylidene-5-phenyl-5-thiophen-2-yloxolan-2-one.
Chemical Property Profile of 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one
Property Insights of 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one
The XLogP value of 3.5 indicates that 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.5 Ų, 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-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 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one?
The CAS number of 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one is 71741-89-4.
What is the molecular formula of 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one?
The molecular formula of 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one is C15H12O2S.
What is the molecular weight of 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one?
The molecular weight of 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one is 256.06 g/mol.
Where can I buy 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one?
You can request a quote for 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylidene-5-phenyl-5-(thiophen-2-yl)oxolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.