(2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one
TL;DR: (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one (CAS 31356-11-3) is a chemical compound with molecular formula C16H12O3 and molecular weight 252.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-benzylidene-6-methoxy-1-benzofuran-3-one
Also Known As: 6-Methoxyaurone, (Z)-6-Methoxyaurone, SARS-CoV-2-IN-43, MEGxp0_001758, ACon1_002240
| Molecular Formula | C16H12O3 |
|---|---|
| Molecular Weight | 252.08 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 252.07864 |
| Heavy Atoms | 19 |
| Complexity | 368.0 |
Chemical Identifiers
| CAS Number | 31356-11-3 |
|---|---|
| SMILES | COC1=CC2=C(C=C1)C(=O)/C(=C/C3=CC=CC=C3)/O2 |
| InChIKey | LKWWJGGLULNRBP-DHDCSXOGSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one (CAS 31356-11-3), with molecular formula C16H12O3 and molecular weight 252.08 g/mol. IUPAC: (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3-one.
Chemical Property Profile of (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one
Property Insights of (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one
The XLogP value of 3.6 indicates that (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-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 (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one?
The CAS number of (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one is 31356-11-3.
What is the molecular formula of (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one?
The molecular formula of (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one is C16H12O3.
What is the molecular weight of (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one?
The molecular weight of (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one is 252.08 g/mol.
Where can I buy (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one?
You can request a quote for (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-2-benzylidene-6-methoxy-1-benzofuran-3(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.