![[2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate structure](/static/products/4386/438607-49-9.webp)
[2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate
TL;DR: [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate (CAS 438607-49-9) is a chemical compound with molecular formula C22H18N2O9S and molecular weight 486.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate
Also Known As: [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate|[2-(4-methoxyphenyl)-2-oxo-ethyl] 2-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]benzoate|2-(4-methoxyphenyl)-2-oxoethyl 2-(4-hydroxy-3-nitrobenzenesulfonamido)benzoate|2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester|SMR000371540|MLS000776538|MLS003912285
| Molecular Formula | C22H18N2O9S |
|---|---|
| Molecular Weight | 486.07 g/mol |
| LogP | 3.1495 |
| Topological Polar Surface Area | 162.14 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 486.0733 |
| Heavy Atoms | 34 |
| Complexity | 1353.0431 |
Chemical Identifiers
| CAS Number | 438607-49-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2NS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-] |
Product Overview
[2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate (CAS 438607-49-9), with molecular formula C22H18N2O9S and molecular weight 486.07 g/mol. IUPAC: [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate.
Chemical Property Profile of [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate
Property Insights of [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate
The XLogP value of 3.1495 indicates that [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 162.14 Ų indicates high polarity, suggesting [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate has 2 hydrogen bond donor(s) and 9 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 [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate?
The CAS number of [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate is 438607-49-9.
What is the molecular formula of [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate?
The molecular formula of [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate is C22H18N2O9S.
What is the molecular weight of [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate?
The molecular weight of [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate is 486.07 g/mol.
Where can I buy [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate?
You can request a quote for [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-methoxyphenyl)-2-oxoethyl] 2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.