3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide
TL;DR: 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide (CAS 39576-76-6) is a chemical compound with molecular formula C10H10N2O3S and molecular weight 238.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide
Also Known As: 3-methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide, 2-(Methanesulfinyl)-3-methyl-1-oxoquinoxalin-1-ium-4(1H)-olate
| Molecular Formula | C10H10N2O3S |
|---|---|
| Molecular Weight | 238.04 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 82.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 238.04121 |
| Heavy Atoms | 16 |
| Complexity | 380.0 |
Chemical Identifiers
| CAS Number | 39576-76-6 |
|---|---|
| SMILES | CC1=C([N+](=O)C2=CC=CC=C2N1[O-])S(=O)C |
| InChIKey | NWLKFWAOSGUDEK-UHFFFAOYSA-N |
Product Overview
3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide (CAS 39576-76-6), with molecular formula C10H10N2O3S and molecular weight 238.04 g/mol. IUPAC: 3-methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide.
Chemical Property Profile of 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide
Property Insights of 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide
The XLogP value of -0.3 indicates that 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 82.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide. Following Lipinski's Rule of Five, 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide has 0 hydrogen bond donor(s) and 5 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-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide?
The CAS number of 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide is 39576-76-6.
What is the molecular formula of 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide?
The molecular formula of 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide is C10H10N2O3S.
What is the molecular weight of 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide?
The molecular weight of 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide is 238.04 g/mol.
Where can I buy 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide?
You can request a quote for 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-2-methylsulfinyl-4-oxidoquinoxalin-1-ium 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.