3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one
TL;DR: 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one (CAS 40598-93-4) is a chemical compound with molecular formula C14H10N2O2S and molecular weight 270.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one
Also Known As: 3-(2-oxo-2-(thiophen-2-yl)ethyl)quinoxalin-2(1H)-one, 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one, 3-(2-oxo-2-thien-2-ylethyl)quinoxalin-2(1H)-one, 2-hydroxy-3-(2'-thienoylmethyl)quinoxaline, 3-[2-oxo-2-(thiophen-2-yl)ethyl]-1,2-dihydroquinoxalin-2-one
| Molecular Formula | C14H10N2O2S |
|---|---|
| Molecular Weight | 270.05 g/mol |
| LogP | 2.41 |
| Topological Polar Surface Area | 62.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 270.0463 |
| Heavy Atoms | 19 |
| Complexity | 790.5661 |
Chemical Identifiers
| CAS Number | 40598-93-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=O)C(=N2)CC(=O)C3=CC=CS3 |
Product Overview
3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one (CAS 40598-93-4), with molecular formula C14H10N2O2S and molecular weight 270.05 g/mol. IUPAC: 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one.
Chemical Property Profile of 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one
Property Insights of 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one
The XLogP value of 2.41 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one. The TPSA of 62.82 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one. Following Lipinski's Rule of Five, 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one has 1 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 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one?
The CAS number of 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one is 40598-93-4.
What is the molecular formula of 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one?
The molecular formula of 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one is C14H10N2O2S.
What is the molecular weight of 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one?
The molecular weight of 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one is 270.05 g/mol.
Where can I buy 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one?
You can request a quote for 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-oxo-2-thiophen-2-ylethyl)-1H-quinoxalin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.