VU0617566-1
TL;DR: VU0617566-1 (CAS 623117-70-4) is a chemical compound with molecular formula C22H22O6 and molecular weight 382.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2-[[(2Z)-2-[(2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetate
Also Known As: VU0617566-1, (Z)-tert-butyl 2-((2-(2-methoxybenzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl)oxy)acetate, F3385-5033, tert-butyl 2-[[(2Z)-2-[(2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetate, tert-butyl 2-{[(2Z)-2-[(2-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetate
| Molecular Formula | C22H22O6 |
|---|---|
| Molecular Weight | 382.14 g/mol |
| LogP | 4.0319 |
| Topological Polar Surface Area | 71.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.14163 |
| Heavy Atoms | 28 |
| Complexity | 936.28345 |
Chemical Identifiers
| CAS Number | 623117-70-4 |
|---|---|
| SMILES | CC(C)(C)OC(=O)COC1=CC2=C(C=C1)C(=O)/C(=C/C3=CC=CC=C3OC)/O2 |
Product Overview
VU0617566-1 (CAS 623117-70-4), with molecular formula C22H22O6 and molecular weight 382.14 g/mol. IUPAC: tert-butyl 2-[[(2Z)-2-[(2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetate.
Chemical Property Profile of VU0617566-1
Property Insights of VU0617566-1
The XLogP value of 4.0319 indicates that VU0617566-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.06 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0617566-1. Following Lipinski's Rule of Five, VU0617566-1 has 0 hydrogen bond donor(s) and 6 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 VU0617566-1?
The CAS number of VU0617566-1 is 623117-70-4.
What is the molecular formula of VU0617566-1?
The molecular formula of VU0617566-1 is C22H22O6.
What is the molecular weight of VU0617566-1?
The molecular weight of VU0617566-1 is 382.14 g/mol.
Where can I buy VU0617566-1?
You can request a quote for VU0617566-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0617566-1?
Yes, KEHONG BIO provides custom synthesis services for VU0617566-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.