N,N-diethyl-2-nitrobenzenesulfonamide
TL;DR: N,N-diethyl-2-nitrobenzenesulfonamide (CAS 77925-51-0) is a chemical compound with molecular formula C10H14N2O4S and molecular weight 258.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-nitrobenzenesulfonamide
Also Known As: N,N-diethyl-2-nitrobenzenesulfonamide, Benzenesulfonamide, N,N-diethyl-2-nitro-, N,N-diethyl-2-nitro-benzenesulfonamide, o-nitro-N,N-diethylbenzenesulfonamide, 2-nitro-benzenesulfonic acid diethylamide
| Molecular Formula | C10H14N2O4S |
|---|---|
| Molecular Weight | 258.07 g/mol |
| LogP | 1.6253 |
| Topological Polar Surface Area | 80.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 258.0674 |
| Heavy Atoms | 17 |
| Complexity | 508.7921 |
Chemical Identifiers
| CAS Number | 77925-51-0 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC=CC=C1[N+](=O)[O-] |
Product Overview
N,N-diethyl-2-nitrobenzenesulfonamide (CAS 77925-51-0), with molecular formula C10H14N2O4S and molecular weight 258.07 g/mol. IUPAC: N,N-diethyl-2-nitrobenzenesulfonamide.
Chemical Property Profile of N,N-diethyl-2-nitrobenzenesulfonamide
Property Insights of N,N-diethyl-2-nitrobenzenesulfonamide
The XLogP value of 1.6253 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-diethyl-2-nitrobenzenesulfonamide. The TPSA of 80.52 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-diethyl-2-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N,N-diethyl-2-nitrobenzenesulfonamide has 0 hydrogen bond donor(s) and 4 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,N-diethyl-2-nitrobenzenesulfonamide?
The CAS number of N,N-diethyl-2-nitrobenzenesulfonamide is 77925-51-0.
What is the molecular formula of N,N-diethyl-2-nitrobenzenesulfonamide?
The molecular formula of N,N-diethyl-2-nitrobenzenesulfonamide is C10H14N2O4S.
What is the molecular weight of N,N-diethyl-2-nitrobenzenesulfonamide?
The molecular weight of N,N-diethyl-2-nitrobenzenesulfonamide is 258.07 g/mol.
Where can I buy N,N-diethyl-2-nitrobenzenesulfonamide?
You can request a quote for N,N-diethyl-2-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethyl-2-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-2-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.