1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide
TL;DR: 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide (CAS 672934-81-5) is a chemical compound with molecular formula C23H19N3O7 and molecular weight 449.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dimethoxyphenyl)methoxy]-3-(3-nitrophenyl)-4-oxidoquinoxalin-4-ium-2-one
Also Known As: 4-((3,4-dimethoxybenzyl)oxy)-2-(3-nitrophenyl)-3-oxo-3,4-dihydroquinoxaline 1-oxide, 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide, 1-[(3,4-dimethoxyphenyl)methoxy]-3-(3-nitrophenyl)-4-oxido-quinoxalin-2-one, 1-[(3,4-dimethoxyphenyl)methoxy]-3-(3-nitrophenyl)-4-oxidoquinoxalin-4-ium-2-one
| Molecular Formula | C23H19N3O7 |
|---|---|
| Molecular Weight | 449.12 g/mol |
| LogP | 2.8561 |
| Topological Polar Surface Area | 119.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 449.1223 |
| Heavy Atoms | 33 |
| Complexity | 1415.3373 |
Chemical Identifiers
| CAS Number | 672934-81-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CON2C3=CC=CC=C3[N+](=C(C2=O)C4=CC(=CC=C4)[N+](=O)[O-])[O-])OC |
Product Overview
1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide (CAS 672934-81-5), with molecular formula C23H19N3O7 and molecular weight 449.12 g/mol. IUPAC: 1-[(3,4-dimethoxyphenyl)methoxy]-3-(3-nitrophenyl)-4-oxidoquinoxalin-4-ium-2-one.
Chemical Property Profile of 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide
Property Insights of 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide
The XLogP value of 2.8561 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide. The TPSA of 119.77 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide. Following Lipinski's Rule of Five, 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide 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 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide?
The CAS number of 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide is 672934-81-5.
What is the molecular formula of 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide?
The molecular formula of 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide is C23H19N3O7.
What is the molecular weight of 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide?
The molecular weight of 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide is 449.12 g/mol.
Where can I buy 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide?
You can request a quote for 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)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-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide?
Yes, KEHONG BIO provides custom synthesis services for 1-[(3,4-dimethoxybenzyl)oxy]-3-(3-nitrophenyl)quinoxalin-2(1H)-one 4-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.