Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate
TL;DR: Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate (CAS 16362-53-1) is a chemical compound with molecular formula C15H13ClN2O6S and molecular weight 384.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[(4-chloro-3-nitrophenyl)sulfonylamino]benzoate
Also Known As: ETHYL 4-(4-CHLORO-3-NITROBENZENESULFONAMIDO)BENZOATE, ethyl 4-[(4-chloro-3-nitrophenyl)sulfonylamino]benzoate, ethyl 4-[(4-chloro-3-nitrobenzene)sulfonamido]benzoate, ethyl 4-[(4-chloro-3-nitro-phenyl)sulfonylamino]benzoate, ETHYL4-(4-CHLORO-3-NITROBENZENESULFONAMIDO)BENZOATE
| Molecular Formula | C15H13ClN2O6S |
|---|---|
| Molecular Weight | 384.02 g/mol |
| LogP | 3.2257 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 384.01828 |
| Heavy Atoms | 25 |
| Complexity | 912.1189 |
Chemical Identifiers
| CAS Number | 16362-53-1 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-] |
Product Overview
Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate (CAS 16362-53-1), with molecular formula C15H13ClN2O6S and molecular weight 384.02 g/mol. IUPAC: ethyl 4-[(4-chloro-3-nitrophenyl)sulfonylamino]benzoate.
Chemical Property Profile of Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate
Property Insights of Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate
The XLogP value of 3.2257 indicates that Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.61 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate. Following Lipinski's Rule of Five, Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate 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 Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate?
The CAS number of Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate is 16362-53-1.
What is the molecular formula of Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate?
The molecular formula of Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate is C15H13ClN2O6S.
What is the molecular weight of Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate?
The molecular weight of Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate is 384.02 g/mol.
Where can I buy Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate?
You can request a quote for Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-(4-chloro-3-nitrobenzenesulfonamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.