![2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile structure](/static/products/300/300376-40-3.png)
2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile
TL;DR: 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile (CAS 300376-40-3) is a chemical compound with molecular formula C18H11N7O4 and molecular weight 389.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-(4-methylphenyl)-6,7-dinitropyrrolo[3,2-b]quinoxaline-3-carbonitrile
Also Known As: 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile, 2-amino-1-(4-methylphenyl)-6,7-dinitropyrrolo[3,2-b]quinoxaline-3-carbonitrile, 2-amino-6,7-dinitro-1-(p-tolyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile
| Molecular Formula | C18H11N7O4 |
|---|---|
| Molecular Weight | 389.09 g/mol |
| LogP | 3.1524 |
| Topological Polar Surface Area | 166.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 389.08725 |
| Heavy Atoms | 29 |
| Complexity | 1384.1072 |
Chemical Identifiers
| CAS Number | 300376-40-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=C(C3=NC4=CC(=C(C=C4N=C32)[N+](=O)[O-])[N+](=O)[O-])C#N)N |
Product Overview
2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile (CAS 300376-40-3), with molecular formula C18H11N7O4 and molecular weight 389.09 g/mol. IUPAC: 2-amino-1-(4-methylphenyl)-6,7-dinitropyrrolo[3,2-b]quinoxaline-3-carbonitrile.
Chemical Property Profile of 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile
Property Insights of 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile
The XLogP value of 3.1524 indicates that 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 166.8 Ų indicates high polarity, suggesting 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile has 1 hydrogen bond donor(s) and 8 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-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile?
The CAS number of 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile is 300376-40-3.
What is the molecular formula of 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile?
The molecular formula of 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile is C18H11N7O4.
What is the molecular weight of 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile?
The molecular weight of 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile is 389.09 g/mol.
Where can I buy 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile?
You can request a quote for 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-1-(4-methylphenyl)-6,7-dinitro-1H-pyrrolo[2,3-b]quinoxaline-3-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.