![(E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine structure](/static/products/844/844458-67-9.png)
(E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine
TL;DR: (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine (CAS 844458-67-9) is a chemical compound with molecular formula C27H25N5O3S and molecular weight 499.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,5-dimethylphenyl)sulfonyl-1-[(E)-(4-ethoxyphenyl)methylideneamino]pyrrolo[3,2-b]quinoxalin-2-amine
Also Known As: (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine, 3-(2,5-dimethylphenyl)sulfonyl-1-[(E)-(4-ethoxyphenyl)methylideneamino]pyrrolo[3,2-b]quinoxalin-2-amine, 3-[(2,5-dimethylphenyl)sulfonyl]-N~1~-[(E)-(4-ethoxyphenyl)methylidene]-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine
| Molecular Formula | C27H25N5O3S |
|---|---|
| Molecular Weight | 499.17 g/mol |
| LogP | 4.89724 |
| Topological Polar Surface Area | 112.46 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 499.16782 |
| Heavy Atoms | 36 |
| Complexity | 1739.708 |
Chemical Identifiers
| CAS Number | 844458-67-9 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)/C=N/N2C(=C(C3=NC4=CC=CC=C4N=C32)S(=O)(=O)C5=C(C=CC(=C5)C)C)N |
Product Overview
(E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine (CAS 844458-67-9), with molecular formula C27H25N5O3S and molecular weight 499.17 g/mol. IUPAC: 3-(2,5-dimethylphenyl)sulfonyl-1-[(E)-(4-ethoxyphenyl)methylideneamino]pyrrolo[3,2-b]quinoxalin-2-amine.
Chemical Property Profile of (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine
Property Insights of (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine
The XLogP value of 4.89724 indicates that (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.46 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine. Following Lipinski's Rule of Five, (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine has 1 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 (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine?
The CAS number of (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine is 844458-67-9.
What is the molecular formula of (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine?
The molecular formula of (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine is C27H25N5O3S.
What is the molecular weight of (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine?
The molecular weight of (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine is 499.17 g/mol.
Where can I buy (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine?
You can request a quote for (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-((2,5-dimethylphenyl)sulfonyl)-N1-(4-ethoxybenzylidene)-1H-pyrrolo[2,3-b]quinoxaline-1,2-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.