N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide
TL;DR: N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide (CAS 117561-96-3) is a chemical compound with molecular formula C14H14N2O4S and molecular weight 306.0674 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2,3-dimethylphenyl)-2-nitrobenzenesulfonamide
Also Known As: N-(2,3-dimethylphenyl)-2-nitrobenzenesulfonamide, Benzenesulfonamide, N-(2,3-dimethylphenyl)-2-nitro-, N-(2,3-Dimethylphenyl)-2-nitrobenzene-1-sulfonamide
Technical Specifications
| Molecular Formula | C14H14N2O4S |
| Molecular Weight | 306.0674 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.0674 Da |
| Heavy Atoms | 21 |
| Complexity | 468.0 |
| SMILES | CC1=C(C(=CC=C1)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C |
| InChIKey | KNUICVKDMQGVFJ-UHFFFAOYSA-N |
Chemical Property Profile of N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide
Property Insights of N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide
The XLogP value of 3.0 indicates that N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide 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 N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide 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
What is the CAS number of N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide?
The CAS number of N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide is 117561-96-3.
What is the molecular formula of N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide?
The molecular formula of N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide is C14H14N2O4S.
What is the molecular weight of N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide?
The molecular weight of N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide is 306.0674 g/mol.
Where can I buy N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide?
You can request a quote for N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide?
Yes, CoreyChem provides custom synthesis services for N-(2,3-Dimethylphenyl)-2-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.