2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile
TL;DR: 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile (CAS 1005082-74-5) is a chemical compound with molecular formula C24H26N4O3S and molecular weight 450.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile
Also Known As: 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile, [3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl][(3,4-dimethylphenyl)sulfonyl]acetonitrile, 2-(3-(2,6-dimethylmorpholino)quinoxalin-2-yl)-2-((3,4-dimethylphenyl)sulfonyl)acetonitrile, 2-[3-(2,6-dimethylmorpholino)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonyl-acetonitrile, 2-[3-(2,6-dimethyl-4-morpholinyl)-2-quinoxalinyl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile
| Molecular Formula | C24H26N4O3S |
|---|---|
| Molecular Weight | 450.17 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 450.17258 |
| Heavy Atoms | 32 |
| Complexity | 796.0 |
Chemical Identifiers
| CAS Number | 1005082-74-5 |
|---|---|
| SMILES | CC1CN(CC(O1)C)C2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC(=C(C=C4)C)C |
| InChIKey | VMDPAZZHRVIKEL-UHFFFAOYSA-N |
Product Overview
2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile (CAS 1005082-74-5), with molecular formula C24H26N4O3S and molecular weight 450.17 g/mol. IUPAC: 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile.
Chemical Property Profile of 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile
Property Insights of 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile
The XLogP value of 3.6 indicates that 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile. Following Lipinski's Rule of Five, 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile 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 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile?
The CAS number of 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile is 1005082-74-5.
What is the molecular formula of 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile?
The molecular formula of 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile is C24H26N4O3S.
What is the molecular weight of 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile?
The molecular weight of 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile is 450.17 g/mol.
Where can I buy 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile?
You can request a quote for 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(2,6-dimethylmorpholin-4-yl)quinoxalin-2-yl]-2-(3,4-dimethylphenyl)sulfonylacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.