(3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate
TL;DR: (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate (CAS 850720-69-3) is a chemical compound with molecular formula C20H18N2O5 and molecular weight 366.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-acetyl-6-methoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methylbenzoate
Also Known As: (3-acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate, (3-acetyl-6-methoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methylbenzoate, 2-acetyl-7-methoxy-3-(((4-methylbenzoyl)oxy)methyl)quinoxaline 1-oxide
| Molecular Formula | C20H18N2O5 |
|---|---|
| Molecular Weight | 366.12 g/mol |
| LogP | 2.74482 |
| Topological Polar Surface Area | 92.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 366.12158 |
| Heavy Atoms | 27 |
| Complexity | 1028.7167 |
Chemical Identifiers
| CAS Number | 850720-69-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OCC2=NC3=C(C=C(C=C3)OC)[N+](=C2C(=O)C)[O-] |
Product Overview
(3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate (CAS 850720-69-3), with molecular formula C20H18N2O5 and molecular weight 366.12 g/mol. IUPAC: (3-acetyl-6-methoxy-4-oxidoquinoxalin-4-ium-2-yl)methyl 4-methylbenzoate.
Chemical Property Profile of (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate
Property Insights of (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate
The XLogP value of 2.74482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate. The TPSA of 92.43 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate. Following Lipinski's Rule of Five, (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate 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-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate?
The CAS number of (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate is 850720-69-3.
What is the molecular formula of (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate?
The molecular formula of (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate is C20H18N2O5.
What is the molecular weight of (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate?
The molecular weight of (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate is 366.12 g/mol.
Where can I buy (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate?
You can request a quote for (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate 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-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for (3-Acetyl-6-methoxy-4-oxidoquinoxalin-2-yl)methyl 4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.