N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide
TL;DR: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide (CAS 321706-24-5) is a chemical compound with molecular formula C16H18N2O6S and molecular weight 366.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide
Also Known As: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide, BAS 01926471, BIM-0045806.P001, (2-(3,4-DIMETHOXYPHENYL)ETHYL)((4-NITROPHENYL)SULFONYL)AMINE, N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzene-1-sulfonamide
| Molecular Formula | C16H18N2O6S |
|---|---|
| Molecular Weight | 366.09 g/mol |
| LogP | 2.133 |
| Topological Polar Surface Area | 107.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 366.08856 |
| Heavy Atoms | 25 |
| Complexity | 849.4287 |
Chemical Identifiers
| CAS Number | 321706-24-5 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])OC |
Product Overview
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide (CAS 321706-24-5), with molecular formula C16H18N2O6S and molecular weight 366.09 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide.
Chemical Property Profile of N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide
Property Insights of N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide
The XLogP value of 2.133 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide. The TPSA of 107.77 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide. Following Lipinski's Rule of Five, N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide has 1 hydrogen bond donor(s) and 6 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-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide?
The CAS number of N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide is 321706-24-5.
What is the molecular formula of N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide?
The molecular formula of N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide is C16H18N2O6S.
What is the molecular weight of N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide?
The molecular weight of N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide is 366.09 g/mol.
Where can I buy N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide?
You can request a quote for N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(3,4-dimethoxyphenyl)ethyl]-4-nitrobenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.