4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide
TL;DR: 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide (CAS 218156-97-9) is a chemical compound with molecular formula C16H14ClN3O5S and molecular weight 395.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide
Also Known As: 4-(2-chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide, 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzene-1-sulfonamide, RefChem:287150
| Molecular Formula | C16H14ClN3O5S |
|---|---|
| Molecular Weight | 395.03 g/mol |
| LogP | 3.57468 |
| Topological Polar Surface Area | 113.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 395.03427 |
| Heavy Atoms | 26 |
| Complexity | 954.84076 |
Chemical Identifiers
| CAS Number | 218156-97-9 |
|---|---|
| SMILES | CN(CCC#N)S(=O)(=O)C1=CC=C(C=C1)OC2=C(C=CC=C2Cl)[N+](=O)[O-] |
Product Overview
4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide (CAS 218156-97-9), with molecular formula C16H14ClN3O5S and molecular weight 395.03 g/mol. IUPAC: 4-(2-chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide.
Chemical Property Profile of 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide
Property Insights of 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide
The XLogP value of 3.57468 indicates that 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide. Following Lipinski's Rule of Five, 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide has 0 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 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide?
The CAS number of 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide is 218156-97-9.
What is the molecular formula of 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide?
The molecular formula of 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide is C16H14ClN3O5S.
What is the molecular weight of 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide?
The molecular weight of 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide is 395.03 g/mol.
Where can I buy 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide?
You can request a quote for 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Chloro-6-nitrophenoxy)-N-(2-cyanoethyl)-N-methylbenzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.