2-硝基甲苯-4-磺酰胺
TL;DR: 2-硝基甲苯-4-磺酰胺 (CAS 6949-23-1) is a chemical compound with molecular formula C7H8N2O4S and molecular weight 216.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-硝基甲苯-4-磺酰胺
4-methyl-3-nitrobenzenesulfonamide
Also Known As: 4-methyl-3-nitrobenzenesulfonamide, 2-Nitrotoluene-4-sulphonamide, Pazopanib Impurity 27, Pazopanib Impurity 31, 4-methyl-3-nitrobenzene-1-sulfonamide
| Molecular Formula | C7H8N2O4S |
|---|---|
| Molecular Weight | 216.02 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 216.02048 |
| Heavy Atoms | 14 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 6949-23-1 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)S(=O)(=O)N)[N+](=O)[O-] |
| InChIKey | HVCWTENLJRUJPU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-硝基甲苯-4-磺酰胺 (CAS 6949-23-1), with molecular formula C7H8N2O4S and molecular weight 216.02 g/mol. IUPAC: 4-methyl-3-nitrobenzenesulfonamide.
Chemical Property Profile of 2-硝基甲苯-4-磺酰胺
Property Insights of 2-硝基甲苯-4-磺酰胺
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-硝基甲苯-4-磺酰胺. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-硝基甲苯-4-磺酰胺. Following Lipinski's Rule of Five, 2-硝基甲苯-4-磺酰胺 has 1 hydrogen bond donor(s) and 5 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-硝基甲苯-4-磺酰胺?
The CAS number of 2-硝基甲苯-4-磺酰胺 is 6949-23-1.
What is the molecular formula of 2-硝基甲苯-4-磺酰胺?
The molecular formula of 2-硝基甲苯-4-磺酰胺 is C7H8N2O4S.
What is the molecular weight of 2-硝基甲苯-4-磺酰胺?
The molecular weight of 2-硝基甲苯-4-磺酰胺 is 216.02 g/mol.
Where can I buy 2-硝基甲苯-4-磺酰胺?
You can request a quote for 2-硝基甲苯-4-磺酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-硝基甲苯-4-磺酰胺?
Yes, KEHONG BIO provides custom synthesis services for 2-硝基甲苯-4-磺酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.