2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide
TL;DR: 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide (CAS 849026-90-0) is a chemical compound with molecular formula C21H14N2O4S and molecular weight 390.07 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 thiophene-2-carboxylate
Also Known As: 2-benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide, (3-benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl thiophene-2-carboxylate, [4-oxido-3-(phenylcarbonyl)quinoxalin-2-yl]methyl thiophene-2-carboxylate, Thiophene-2-carboxylic acid 3-benzoyl-4-oxy-quinoxalin-2-ylmethyl ester
| Molecular Formula | C21H14N2O4S |
|---|---|
| Molecular Weight | 390.07 g/mol |
| LogP | 3.5177 |
| Topological Polar Surface Area | 83.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 390.0674 |
| Heavy Atoms | 28 |
| Complexity | 1157.9779 |
Chemical Identifiers
| CAS Number | 849026-90-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)C2=[N+](C3=CC=CC=C3N=C2COC(=O)C4=CC=CS4)[O-] |
Product Overview
2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide (CAS 849026-90-0), with molecular formula C21H14N2O4S and molecular weight 390.07 g/mol. IUPAC: (3-benzoyl-4-oxidoquinoxalin-4-ium-2-yl)methyl thiophene-2-carboxylate.
Chemical Property Profile of 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide
Property Insights of 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide
The XLogP value of 3.5177 indicates that 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide. Following Lipinski's Rule of Five, 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide 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 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide?
The CAS number of 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide is 849026-90-0.
What is the molecular formula of 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide?
The molecular formula of 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide is C21H14N2O4S.
What is the molecular weight of 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide?
The molecular weight of 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide is 390.07 g/mol.
Where can I buy 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide?
You can request a quote for 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzoyl-3-(((thiophene-2-carbonyl)oxy)methyl)quinoxaline 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.