(3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate
TL;DR: (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate (CAS 862128-79-8) is a chemical compound with molecular formula C21H20N2O6 and molecular weight 396.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate
Also Known As: (3-acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate, 2-acetyl-7-ethoxy-3-(((4-methoxybenzoyl)oxy)methyl)quinoxaline 1-oxide, (3-acetyl-6-ethoxy-4-oxidoquinoxalin-2-yl)methyl 4-methoxybenzoate
| Molecular Formula | C21H20N2O6 |
|---|---|
| Molecular Weight | 396.13 g/mol |
| LogP | 2.8351 |
| Topological Polar Surface Area | 101.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 396.13214 |
| Heavy Atoms | 29 |
| Complexity | 1062.9496 |
Chemical Identifiers
| CAS Number | 862128-79-8 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)N=C(C(=[N+]2[O-])C(=O)C)COC(=O)C3=CC=C(C=C3)OC |
Product Overview
(3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate (CAS 862128-79-8), with molecular formula C21H20N2O6 and molecular weight 396.13 g/mol. IUPAC: (3-acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate.
Chemical Property Profile of (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate
Property Insights of (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate
The XLogP value of 2.8351 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate. The TPSA of 101.66 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate. Following Lipinski's Rule of Five, (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate 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 (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate?
The CAS number of (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate is 862128-79-8.
What is the molecular formula of (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate?
The molecular formula of (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate is C21H20N2O6.
What is the molecular weight of (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate?
The molecular weight of (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate is 396.13 g/mol.
Where can I buy (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate?
You can request a quote for (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for (3-Acetyl-6-ethoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.