N-环己基-N-甲基-2-硝基苯磺酰胺
TL;DR: N-环己基-N-甲基-2-硝基苯磺酰胺 (CAS 70693-58-2) is a chemical compound with molecular formula C13H18N2O4S and molecular weight 298.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-环己基-N-甲基-2-硝基苯磺酰胺
N-cyclohexyl-N-methyl-2-nitrobenzenesulfonamide
Also Known As: N-cyclohexyl-N-methyl-2-nitrobenzenesulfonamide, Benzenesulfonamide, N-cyclohexyl-N-methyl-2-nitro-, N-Cyclohexyl-N-methyl-2-nitrobenzenesulphonamide, 2-(Cyclohexylmethylsulfamoyl)-1-nitrobenzene, N-Cyclohexyl-N-methyl-2-nitro-benzenesulfonamide
| Molecular Formula | C13H18N2O4S |
|---|---|
| Molecular Weight | 298.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 91.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.09872 |
| Heavy Atoms | 20 |
| Complexity | 434.0 |
Chemical Identifiers
| CAS Number | 70693-58-2 |
|---|---|
| SMILES | CN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-] |
| InChIKey | USBCPCFTYCPFDC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-环己基-N-甲基-2-硝基苯磺酰胺 (CAS 70693-58-2), with molecular formula C13H18N2O4S and molecular weight 298.10 g/mol. IUPAC: N-cyclohexyl-N-methyl-2-nitrobenzenesulfonamide.
Chemical Property Profile of N-环己基-N-甲基-2-硝基苯磺酰胺
Property Insights of N-环己基-N-甲基-2-硝基苯磺酰胺
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-环己基-N-甲基-2-硝基苯磺酰胺. The TPSA of 91.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-环己基-N-甲基-2-硝基苯磺酰胺. Following Lipinski's Rule of Five, N-环己基-N-甲基-2-硝基苯磺酰胺 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-环己基-N-甲基-2-硝基苯磺酰胺?
The CAS number of N-环己基-N-甲基-2-硝基苯磺酰胺 is 70693-58-2.
What is the molecular formula of N-环己基-N-甲基-2-硝基苯磺酰胺?
The molecular formula of N-环己基-N-甲基-2-硝基苯磺酰胺 is C13H18N2O4S.
What is the molecular weight of N-环己基-N-甲基-2-硝基苯磺酰胺?
The molecular weight of N-环己基-N-甲基-2-硝基苯磺酰胺 is 298.10 g/mol.
Where can I buy N-环己基-N-甲基-2-硝基苯磺酰胺?
You can request a quote for N-环己基-N-甲基-2-硝基苯磺酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-环己基-N-甲基-2-硝基苯磺酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-环己基-N-甲基-2-硝基苯磺酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.