VU0617179-1
TL;DR: VU0617179-1 (CAS 900897-73-6) is a chemical compound with molecular formula C18H13BrO6 and molecular weight 403.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[(2Z)-2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetic acid
Also Known As: VU0617179-1, (Z)-2-((2-(5-bromo-2-methoxybenzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl)oxy)acetic acid, F3385-2921, 2-{[(2Z)-2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}acetic acid, 2-[[(2Z)-2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetic acid
| Molecular Formula | C18H13BrO6 |
|---|---|
| Molecular Weight | 403.99 g/mol |
| LogP | 3.5373 |
| Topological Polar Surface Area | 82.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.98956 |
| Heavy Atoms | 25 |
| Complexity | 887.1302 |
Chemical Identifiers
| CAS Number | 900897-73-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Br)/C=C\2/C(=O)C3=C(O2)C=C(C=C3)OCC(=O)O |
Product Overview
VU0617179-1 (CAS 900897-73-6), with molecular formula C18H13BrO6 and molecular weight 403.99 g/mol. IUPAC: 2-[[(2Z)-2-[(5-bromo-2-methoxyphenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetic acid.
Chemical Property Profile of VU0617179-1
Property Insights of VU0617179-1
The XLogP value of 3.5373 indicates that VU0617179-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.06 Ų falls within the moderate polarity range, balancing permeability and solubility for VU0617179-1. Following Lipinski's Rule of Five, VU0617179-1 has 1 hydrogen bond donor(s) and 5 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 VU0617179-1?
The CAS number of VU0617179-1 is 900897-73-6.
What is the molecular formula of VU0617179-1?
The molecular formula of VU0617179-1 is C18H13BrO6.
What is the molecular weight of VU0617179-1?
The molecular weight of VU0617179-1 is 403.99 g/mol.
Where can I buy VU0617179-1?
You can request a quote for VU0617179-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for VU0617179-1?
Yes, KEHONG BIO provides custom synthesis services for VU0617179-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.