(4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate
TL;DR: (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate (CAS 313258-39-8) is a chemical compound with molecular formula C20H13N3O5S and molecular weight 407.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate
Also Known As: (4-quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate, 4-quinoxalin-2-ylphenyl 2-nitrobenzenesulfonate, 4-(2-quinoxalinyl)phenyl 2-nitrobenzenesulfonate, 4-(quinoxalin-2-yl)phenyl 2-nitrobenzenesulfonate, A0345/0015878
| Molecular Formula | C20H13N3O5S |
|---|---|
| Molecular Weight | 407.06 g/mol |
| LogP | 3.9727 |
| Topological Polar Surface Area | 112.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 407.0576 |
| Heavy Atoms | 29 |
| Complexity | 1321.5454 |
Chemical Identifiers
| CAS Number | 313258-39-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=CC(=N2)C3=CC=C(C=C3)OS(=O)(=O)C4=CC=CC=C4[N+](=O)[O-] |
Product Overview
(4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate (CAS 313258-39-8), with molecular formula C20H13N3O5S and molecular weight 407.06 g/mol. IUPAC: (4-quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate.
Chemical Property Profile of (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate
Property Insights of (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate
The XLogP value of 3.9727 indicates that (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.29 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate. Following Lipinski's Rule of Five, (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate 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 (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate?
The CAS number of (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate is 313258-39-8.
What is the molecular formula of (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate?
The molecular formula of (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate is C20H13N3O5S.
What is the molecular weight of (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate?
The molecular weight of (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate is 407.06 g/mol.
Where can I buy (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate?
You can request a quote for (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for (4-Quinoxalin-2-ylphenyl) 2-nitrobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.