2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline
TL;DR: 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline (CAS 355400-58-7) is a chemical compound with molecular formula C27H18N6O3 and molecular weight 474.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-[2-(benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl]quinoxaline
Also Known As: 2-[4-[2-(benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl]quinoxaline, 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline, 2-(4-(2-(2H-benzo[d][1,2,3]triazol-2-yl)-4-methylphenoxy)-3-nitrophenyl)quinoxaline, 2-{4-[2-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline
| Molecular Formula | C27H18N6O3 |
|---|---|
| Molecular Weight | 474.14 g/mol |
| LogP | 6.03962 |
| Topological Polar Surface Area | 108.86 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 474.14404 |
| Heavy Atoms | 36 |
| Complexity | 1746.1577 |
Chemical Identifiers
| CAS Number | 355400-58-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC2=C(C=C(C=C2)C3=NC4=CC=CC=C4N=C3)[N+](=O)[O-])N5N=C6C=CC=CC6=N5 |
Product Overview
2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline (CAS 355400-58-7), with molecular formula C27H18N6O3 and molecular weight 474.14 g/mol. IUPAC: 2-[4-[2-(benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl]quinoxaline.
Chemical Property Profile of 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline
Property Insights of 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline
The XLogP value of 6.03962 indicates that 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline. Following Lipinski's Rule of Five, 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline?
The CAS number of 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline is 355400-58-7.
What is the molecular formula of 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline?
The molecular formula of 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline is C27H18N6O3.
What is the molecular weight of 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline?
The molecular weight of 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline is 474.14 g/mol.
Where can I buy 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline?
You can request a quote for 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline?
Yes, KEHONG BIO provides custom synthesis services for 2-{4-[2-(2H-benzotriazol-2-yl)-4-methylphenoxy]-3-nitrophenyl}quinoxaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.