VU0616667-1
TL;DR: VU0616667-1 (CAS 622794-10-9) is a chemical compound with molecular formula C21H21NO7 and molecular weight 399.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2Z)-3-oxo-2-[(2,3,4-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] N,N-dimethylcarbamate
Also Known As: VU0616667-1, (Z)-3-oxo-2-(2,3,4-trimethoxybenzylidene)-2,3-dihydrobenzofuran-6-yl dimethylcarbamate, F3385-0295, (2Z)-3-oxo-2-[(2,3,4-trimethoxyphenyl)methylidene]-2,3-dihydro-1-benzofuran-6-yl N,N-dimethylcarbamate, [(2Z)-3-oxo-2-[(2,3,4-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] N,N-dimethylcarbamate
| Molecular Formula | C21H21NO7 |
|---|---|
| Molecular Weight | 399.13 g/mol |
| LogP | 3.389 |
| Topological Polar Surface Area | 83.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 399.1318 |
| Heavy Atoms | 29 |
| Complexity | 994.7644 |
Chemical Identifiers
| CAS Number | 622794-10-9 |
|---|---|
| SMILES | CN(C)C(=O)OC1=CC2=C(C=C1)C(=O)/C(=C/C3=C(C(=C(C=C3)OC)OC)OC)/O2 |
Product Overview
VU0616667-1 (CAS 622794-10-9), with molecular formula C21H21NO7 and molecular weight 399.13 g/mol. IUPAC: [(2Z)-3-oxo-2-[(2,3,4-trimethoxyphenyl)methylidene]-1-benzofuran-6-yl] N,N-dimethylcarbamate.
Chemical Property Profile of VU0616667-1
Property Insights of VU0616667-1
The XLogP value of 3.389 indicates that VU0616667-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.53 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0616667-1. Following Lipinski's Rule of Five, VU0616667-1 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 VU0616667-1?
The CAS number of VU0616667-1 is 622794-10-9.
What is the molecular formula of VU0616667-1?
The molecular formula of VU0616667-1 is C21H21NO7.
What is the molecular weight of VU0616667-1?
The molecular weight of VU0616667-1 is 399.13 g/mol.
Where can I buy VU0616667-1?
You can request a quote for VU0616667-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0616667-1?
Yes, KEHONG BIO provides custom synthesis services for VU0616667-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.