1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide
TL;DR: 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide (CAS 797797-72-9) is a chemical compound with molecular formula C26H26N2O4 and molecular weight 430.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-tert-butylphenyl)methoxy]-3-(4-methoxyphenyl)-4-oxidoquinoxalin-4-ium-2-one
Also Known As: 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide, 1-[(4-tert-butylphenyl)methoxy]-3-(4-methoxyphenyl)-4-oxidoquinoxalin-4-ium-2-one, 3-(4-methoxyphenyl)-4-oxido-1-[(4-tert-butylphenyl)methoxy]quinoxalin-2-one, 4-((4-(tert-butyl)benzyl)oxy)-2-(4-methoxyphenyl)-3-oxo-3,4-dihydroquinoxaline 1-oxide
| Molecular Formula | C26H26N2O4 |
|---|---|
| Molecular Weight | 430.19 g/mol |
| LogP | 4.2368 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 430.18927 |
| Heavy Atoms | 32 |
| Complexity | 1301.4763 |
Chemical Identifiers
| CAS Number | 797797-72-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CON2C3=CC=CC=C3[N+](=C(C2=O)C4=CC=C(C=C4)OC)[O-] |
Product Overview
1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide (CAS 797797-72-9), with molecular formula C26H26N2O4 and molecular weight 430.19 g/mol. IUPAC: 1-[(4-tert-butylphenyl)methoxy]-3-(4-methoxyphenyl)-4-oxidoquinoxalin-4-ium-2-one.
Chemical Property Profile of 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide
Property Insights of 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide
The XLogP value of 4.2368 indicates that 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide. Following Lipinski's Rule of Five, 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide has 0 hydrogen bond donor(s) and 4 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 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide?
The CAS number of 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide is 797797-72-9.
What is the molecular formula of 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide?
The molecular formula of 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide is C26H26N2O4.
What is the molecular weight of 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide?
The molecular weight of 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide is 430.19 g/mol.
Where can I buy 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide?
You can request a quote for 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-tert-butylbenzyl)oxy]-3-(4-methoxyphenyl)quinoxalin-2(1H)-one 4-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.