VU0616649-1
TL;DR: VU0616649-1 (CAS 622362-06-5) is a chemical compound with molecular formula C19H11NO4S and molecular weight 349.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2Z)-3-oxo-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] thiophene-2-carboxylate
Also Known As: VU0616649-1, (Z)-3-oxo-2-(pyridin-3-ylmethylene)-2,3-dihydrobenzofuran-6-yl thiophene-2-carboxylate, F3385-0227, [(2Z)-3-oxo-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] thiophene-2-carboxylate, (2Z)-3-oxo-2-[(pyridin-3-yl)methylidene]-2,3-dihydro-1-benzofuran-6-yl thiophene-2-carboxylate
| Molecular Formula | C19H11NO4S |
|---|---|
| Molecular Weight | 349.04 g/mol |
| LogP | 3.9785 |
| Topological Polar Surface Area | 65.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 349.0409 |
| Heavy Atoms | 25 |
| Complexity | 977.9234 |
Chemical Identifiers
| CAS Number | 622362-06-5 |
|---|---|
| SMILES | C1=CC(=CN=C1)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OC(=O)C4=CC=CS4 |
Product Overview
VU0616649-1 (CAS 622362-06-5), with molecular formula C19H11NO4S and molecular weight 349.04 g/mol. IUPAC: [(2Z)-3-oxo-2-(pyridin-3-ylmethylidene)-1-benzofuran-6-yl] thiophene-2-carboxylate.
Chemical Property Profile of VU0616649-1
Property Insights of VU0616649-1
The XLogP value of 3.9785 indicates that VU0616649-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.49 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0616649-1. Following Lipinski's Rule of Five, VU0616649-1 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 VU0616649-1?
The CAS number of VU0616649-1 is 622362-06-5.
What is the molecular formula of VU0616649-1?
The molecular formula of VU0616649-1 is C19H11NO4S.
What is the molecular weight of VU0616649-1?
The molecular weight of VU0616649-1 is 349.04 g/mol.
Where can I buy VU0616649-1?
You can request a quote for VU0616649-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0616649-1?
Yes, KEHONG BIO provides custom synthesis services for VU0616649-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.