![3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine structure](/static/products/844/844648-04-0.png)
3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine
TL;DR: 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine (CAS 844648-04-0) is a chemical compound with molecular formula C25H30N4O2S and molecular weight 450.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylphenyl)sulfonyl-1-octylpyrrolo[3,2-b]quinoxalin-2-amine
Also Known As: 1-octyl-3-tosyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine, 3-(4-methylphenyl)sulfonyl-1-octylpyrrolo[3,2-b]quinoxalin-2-amine, 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine
| Molecular Formula | C25H30N4O2S |
|---|---|
| Molecular Weight | 450.21 g/mol |
| LogP | 5.66842 |
| Topological Polar Surface Area | 90.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 450.20895 |
| Heavy Atoms | 32 |
| Complexity | 1342.1427 |
Chemical Identifiers
| CAS Number | 844648-04-0 |
|---|---|
| SMILES | CCCCCCCCN1C(=C(C2=NC3=CC=CC=C3N=C21)S(=O)(=O)C4=CC=C(C=C4)C)N |
Product Overview
3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine (CAS 844648-04-0), with molecular formula C25H30N4O2S and molecular weight 450.21 g/mol. IUPAC: 3-(4-methylphenyl)sulfonyl-1-octylpyrrolo[3,2-b]quinoxalin-2-amine.
Chemical Property Profile of 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine
Property Insights of 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine
The XLogP value of 5.66842 indicates that 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine. Following Lipinski's Rule of Five, 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine?
The CAS number of 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine is 844648-04-0.
What is the molecular formula of 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine?
The molecular formula of 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine is C25H30N4O2S.
What is the molecular weight of 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine?
The molecular weight of 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine is 450.21 g/mol.
Where can I buy 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine?
You can request a quote for 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-methylphenyl)sulfonyl]-1-octyl-1H-pyrrolo[2,3-b]quinoxalin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.