(3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate
TL;DR: (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate (CAS 861116-96-3) is a chemical compound with molecular formula C25H20N2O5 and molecular weight 428.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate
Also Known As: (3-benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate, 2-benzoyl-3-(((4-ethoxybenzoyl)oxy)methyl)quinoxaline 1-oxide, (3-benzoyl-4-oxido-quinoxalin-2-yl)methyl 4-ethoxybenzoate, [4-oxido-3-(phenylcarbonyl)quinoxalin-2-yl]methyl 4-ethoxybenzoate
| Molecular Formula | C25H20N2O5 |
|---|---|
| Molecular Weight | 428.14 g/mol |
| LogP | 3.8549 |
| Topological Polar Surface Area | 92.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 428.1372 |
| Heavy Atoms | 32 |
| Complexity | 1271.013 |
Chemical Identifiers
| CAS Number | 861116-96-3 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3[N+](=C2C(=O)C4=CC=CC=C4)[O-] |
Product Overview
(3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate (CAS 861116-96-3), with molecular formula C25H20N2O5 and molecular weight 428.14 g/mol. IUPAC: (3-benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate.
Chemical Property Profile of (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate
Property Insights of (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate
The XLogP value of 3.8549 indicates that (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.43 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate. Following Lipinski's Rule of Five, (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate 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 (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate?
The CAS number of (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate is 861116-96-3.
What is the molecular formula of (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate?
The molecular formula of (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate is C25H20N2O5.
What is the molecular weight of (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate?
The molecular weight of (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate is 428.14 g/mol.
Where can I buy (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate?
You can request a quote for (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for (3-Benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-ethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.