N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide
TL;DR: N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide (CAS 68502-28-3) is a chemical compound with molecular formula C8H11N3O4S and molecular weight 245.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-4-(methylamino)-3-nitrobenzenesulfonamide
Also Known As: N-methyl-4-(methylamino)-3-nitrobenzenesulfonamide, 4-(METHYLAMINO)-N-METHYL-3-NITROBENZENESULFONAMIDE, N-methyl-4-(methylamino)-3-nitrobenzene-1-sulfonamide, N-methyl-4-(methylamino)-3-nitro-benzenesulfonamide, 667-358-3
| Molecular Formula | C8H11N3O4S |
|---|---|
| Molecular Weight | 245.05 g/mol |
| LogP | 0.5446 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.04703 |
| Heavy Atoms | 16 |
| Complexity | 512.0148 |
Chemical Identifiers
| CAS Number | 68502-28-3 |
|---|---|
| SMILES | CNC1=C(C=C(C=C1)S(=O)(=O)NC)[N+](=O)[O-] |
Product Overview
N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide (CAS 68502-28-3), with molecular formula C8H11N3O4S and molecular weight 245.05 g/mol. IUPAC: N-methyl-4-(methylamino)-3-nitrobenzenesulfonamide.
Chemical Property Profile of N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide
Property Insights of N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide
The XLogP value of 0.5446 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide has 2 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 N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide?
The CAS number of N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide is 68502-28-3.
What is the molecular formula of N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide?
The molecular formula of N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide is C8H11N3O4S.
What is the molecular weight of N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide?
The molecular weight of N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide is 245.05 g/mol.
Where can I buy N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide?
You can request a quote for N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-Methyl-4-(methylamino)-3-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.