VU0617029-1
TL;DR: VU0617029-1 (CAS 859662-83-2) is a chemical compound with molecular formula C21H18O7 and molecular weight 382.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-[[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-1-benzofuran-6-yl]oxy]acetate
Also Known As: VU0617029-1, (Z)-isopropyl 2-((2-(benzo[d][1,3]dioxol-5-ylmethylene)-3-oxo-2,3-dihydrobenzofuran-6-yl)oxy)acetate, F3385-2353, propan-2-yl 2-{[(2Z)-2-[(2H-1,3-benzodioxol-5-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetate, propan-2-yl 2-[[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-1-benzofuran-6-yl]oxy]acetate
| Molecular Formula | C21H18O7 |
|---|---|
| Molecular Weight | 382.11 g/mol |
| LogP | 3.3619 |
| Topological Polar Surface Area | 80.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 382.10526 |
| Heavy Atoms | 28 |
| Complexity | 974.71454 |
Chemical Identifiers
| CAS Number | 859662-83-2 |
|---|---|
| SMILES | CC(C)OC(=O)COC1=CC2=C(C=C1)C(=O)/C(=C/C3=CC4=C(C=C3)OCO4)/O2 |
Product Overview
VU0617029-1 (CAS 859662-83-2), with molecular formula C21H18O7 and molecular weight 382.11 g/mol. IUPAC: propan-2-yl 2-[[(2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-3-oxo-1-benzofuran-6-yl]oxy]acetate.
Chemical Property Profile of VU0617029-1
Property Insights of VU0617029-1
The XLogP value of 3.3619 indicates that VU0617029-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.29 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0617029-1. Following Lipinski's Rule of Five, VU0617029-1 has 0 hydrogen bond donor(s) and 7 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 VU0617029-1?
The CAS number of VU0617029-1 is 859662-83-2.
What is the molecular formula of VU0617029-1?
The molecular formula of VU0617029-1 is C21H18O7.
What is the molecular weight of VU0617029-1?
The molecular weight of VU0617029-1 is 382.11 g/mol.
Where can I buy VU0617029-1?
You can request a quote for VU0617029-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0617029-1?
Yes, KEHONG BIO provides custom synthesis services for VU0617029-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.