2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide
TL;DR: 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide (CAS 200617-98-7) is a chemical compound with molecular formula C16H18N2O4S and molecular weight 334.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide
Also Known As: BAS 00627717, BIM-0000136.P001, 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide, 5'-NITRO-2,2',4,6-TETRAMETHYLBENZENESULFONANILIDE, (2-methyl-5-nitrophenyl)[(2,4,6-trimethylphenyl)sulfonyl]amine
| Molecular Formula | C16H18N2O4S |
|---|---|
| Molecular Weight | 334.10 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 334.09872 |
| Heavy Atoms | 23 |
| Complexity | 513.0 |
Chemical Identifiers
| CAS Number | 200617-98-7 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])NS(=O)(=O)C2=C(C=C(C=C2C)C)C |
| InChIKey | FFMFWNURNYRRIV-UHFFFAOYSA-N |
Product Overview
2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide (CAS 200617-98-7), with molecular formula C16H18N2O4S and molecular weight 334.10 g/mol. IUPAC: 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide.
Chemical Property Profile of 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide
Property Insights of 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide
The XLogP value of 3.7 indicates that 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide. Following Lipinski's Rule of Five, 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide 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 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide?
The CAS number of 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide is 200617-98-7.
What is the molecular formula of 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide?
The molecular formula of 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide is C16H18N2O4S.
What is the molecular weight of 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide?
The molecular weight of 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide is 334.10 g/mol.
Where can I buy 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide?
You can request a quote for 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-trimethyl-N-(2-methyl-5-nitrophenyl)benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.