VU0616658-1
TL;DR: VU0616658-1 (CAS 622362-56-5) is a chemical compound with molecular formula C22H16O6S and molecular weight 408.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2Z)-2-[(2,3-dimethoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] thiophene-2-carboxylate
Also Known As: VU0616658-1, (Z)-2-(2,3-dimethoxybenzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl thiophene-2-carboxylate, F3385-0274, (2Z)-2-[(2,3-dimethoxyphenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl thiophene-2-carboxylate, [(2Z)-2-[(2,3-dimethoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] thiophene-2-carboxylate
| Molecular Formula | C22H16O6S |
|---|---|
| Molecular Weight | 408.07 g/mol |
| LogP | 4.6007 |
| Topological Polar Surface Area | 71.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 408.06677 |
| Heavy Atoms | 29 |
| Complexity | 1114.336 |
Chemical Identifiers
| CAS Number | 622362-56-5 |
|---|---|
| SMILES | COC1=CC=CC(=C1OC)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=CS4 |
Product Overview
VU0616658-1 (CAS 622362-56-5), with molecular formula C22H16O6S and molecular weight 408.07 g/mol. IUPAC: [(2Z)-2-[(2,3-dimethoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl] thiophene-2-carboxylate.
Chemical Property Profile of VU0616658-1
Property Insights of VU0616658-1
The XLogP value of 4.6007 indicates that VU0616658-1 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 VU0616658-1. Following Lipinski's Rule of Five, VU0616658-1 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 VU0616658-1?
The CAS number of VU0616658-1 is 622362-56-5.
What is the molecular formula of VU0616658-1?
The molecular formula of VU0616658-1 is C22H16O6S.
What is the molecular weight of VU0616658-1?
The molecular weight of VU0616658-1 is 408.07 g/mol.
Where can I buy VU0616658-1?
You can request a quote for VU0616658-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0616658-1?
Yes, KEHONG BIO provides custom synthesis services for VU0616658-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.