N,4-dimethyl-N-nitrobenzenesulfonamide
TL;DR: N,4-dimethyl-N-nitrobenzenesulfonamide (CAS 23114-01-4) is a chemical compound with molecular formula C8H10N2O4S and molecular weight 230.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,4-dimethyl-N-nitrobenzenesulfonamide
Also Known As: N,4-dimethyl-N-nitrobenzenesulfonamide, N-Methyl-N-nitro-toluol-4-sulfonamid, BAS 00323191, Benzenesulfonamide, N,4-dimethyl-N-nitro-, methyl[(4-methylphenyl)sulfonyl]nitroamine
| Molecular Formula | C8H10N2O4S |
|---|---|
| Molecular Weight | 230.04 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 230.03613 |
| Heavy Atoms | 15 |
| Complexity | 322.0 |
Chemical Identifiers
| CAS Number | 23114-01-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(C)[N+](=O)[O-] |
| InChIKey | HPUIGASWJYJKQM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,4-dimethyl-N-nitrobenzenesulfonamide (CAS 23114-01-4), with molecular formula C8H10N2O4S and molecular weight 230.04 g/mol. IUPAC: N,4-dimethyl-N-nitrobenzenesulfonamide.
Chemical Property Profile of N,4-dimethyl-N-nitrobenzenesulfonamide
Property Insights of N,4-dimethyl-N-nitrobenzenesulfonamide
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,4-dimethyl-N-nitrobenzenesulfonamide. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N,4-dimethyl-N-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N,4-dimethyl-N-nitrobenzenesulfonamide has 0 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,4-dimethyl-N-nitrobenzenesulfonamide?
The CAS number of N,4-dimethyl-N-nitrobenzenesulfonamide is 23114-01-4.
What is the molecular formula of N,4-dimethyl-N-nitrobenzenesulfonamide?
The molecular formula of N,4-dimethyl-N-nitrobenzenesulfonamide is C8H10N2O4S.
What is the molecular weight of N,4-dimethyl-N-nitrobenzenesulfonamide?
The molecular weight of N,4-dimethyl-N-nitrobenzenesulfonamide is 230.04 g/mol.
Where can I buy N,4-dimethyl-N-nitrobenzenesulfonamide?
You can request a quote for N,4-dimethyl-N-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,4-dimethyl-N-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N,4-dimethyl-N-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.