VU0510468-1
TL;DR: VU0510468-1 (CAS 844654-04-2) is a chemical compound with molecular formula C17H9ClFNO3 and molecular weight 329.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(2Z)-2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetonitrile
Also Known As: VU0510468-1, (Z)-2-((2-(2-chloro-6-fluorobenzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl)oxy)acetonitrile, F3139-2479, 2-{[(2Z)-2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetonitrile, 2-[[(2Z)-2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetonitrile
| Molecular Formula | C17H9ClFNO3 |
|---|---|
| Molecular Weight | 329.03 g/mol |
| LogP | 3.99768 |
| Topological Polar Surface Area | 59.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 329.0255 |
| Heavy Atoms | 23 |
| Complexity | 850.37756 |
Chemical Identifiers
| CAS Number | 844654-04-2 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OCC#N)F |
Product Overview
VU0510468-1 (CAS 844654-04-2), with molecular formula C17H9ClFNO3 and molecular weight 329.03 g/mol. IUPAC: 2-[[(2Z)-2-[(2-chloro-6-fluorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetonitrile.
Chemical Property Profile of VU0510468-1
Property Insights of VU0510468-1
The XLogP value of 3.99768 indicates that VU0510468-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.32 Ų, VU0510468-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, VU0510468-1 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 VU0510468-1?
The CAS number of VU0510468-1 is 844654-04-2.
What is the molecular formula of VU0510468-1?
The molecular formula of VU0510468-1 is C17H9ClFNO3.
What is the molecular weight of VU0510468-1?
The molecular weight of VU0510468-1 is 329.03 g/mol.
Where can I buy VU0510468-1?
You can request a quote for VU0510468-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0510468-1?
Yes, KEHONG BIO provides custom synthesis services for VU0510468-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.