N,N-diethyl-3,4-dimethoxybenzenesulfonamide
TL;DR: N,N-diethyl-3,4-dimethoxybenzenesulfonamide (CAS 226544-91-8) is a chemical compound with molecular formula C12H19NO4S and molecular weight 273.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-3,4-dimethoxybenzenesulfonamide
Also Known As: N,N-diethyl-3,4-dimethoxybenzenesulfonamide, BAS 02195514, BIM-0018237.P001, [(3,4-dimethoxyphenyl)sulfonyl]diethylamine, N,N-Diethyl-3,4-dimethoxy-benzenesulfonamide
| Molecular Formula | C12H19NO4S |
|---|---|
| Molecular Weight | 273.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 64.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 273.1035 |
| Heavy Atoms | 18 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 226544-91-8 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)OC |
| InChIKey | HGHMNKFJLGKOLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-diethyl-3,4-dimethoxybenzenesulfonamide (CAS 226544-91-8), with molecular formula C12H19NO4S and molecular weight 273.10 g/mol. IUPAC: N,N-diethyl-3,4-dimethoxybenzenesulfonamide.
Chemical Property Profile of N,N-diethyl-3,4-dimethoxybenzenesulfonamide
Property Insights of N,N-diethyl-3,4-dimethoxybenzenesulfonamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-diethyl-3,4-dimethoxybenzenesulfonamide. The TPSA of 64.2 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-diethyl-3,4-dimethoxybenzenesulfonamide. Following Lipinski's Rule of Five, N,N-diethyl-3,4-dimethoxybenzenesulfonamide 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,N-diethyl-3,4-dimethoxybenzenesulfonamide?
The CAS number of N,N-diethyl-3,4-dimethoxybenzenesulfonamide is 226544-91-8.
What is the molecular formula of N,N-diethyl-3,4-dimethoxybenzenesulfonamide?
The molecular formula of N,N-diethyl-3,4-dimethoxybenzenesulfonamide is C12H19NO4S.
What is the molecular weight of N,N-diethyl-3,4-dimethoxybenzenesulfonamide?
The molecular weight of N,N-diethyl-3,4-dimethoxybenzenesulfonamide is 273.10 g/mol.
Where can I buy N,N-diethyl-3,4-dimethoxybenzenesulfonamide?
You can request a quote for N,N-diethyl-3,4-dimethoxybenzenesulfonamide 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-3,4-dimethoxybenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-3,4-dimethoxybenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.