Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester
TL;DR: Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester (CAS 85844-69-5) is a chemical compound with molecular formula C19H30N2O6S and molecular weight 414.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 11-[(3-nitrophenyl)sulfonylamino]undecanoate
Also Known As: Ethyl 11-(((3-nitrophenyl)sulfonyl)amino)undecanoate, Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester, ethyl 11-[(3-nitrophenyl)sulfonylamino]undecanoate, Ethyl 11-(3-nitrobenzene-1-sulfonamido)undecanoate, RefChem:386890
| Molecular Formula | C19H30N2O6S |
|---|---|
| Molecular Weight | 414.18 g/mol |
| LogP | 3.9471 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 15 |
| Exact Mass | 414.18246 |
| Heavy Atoms | 28 |
| Complexity | 720.889 |
Chemical Identifiers
| CAS Number | 85844-69-5 |
|---|---|
| SMILES | CCOC(=O)CCCCCCCCCCNS(=O)(=O)C1=CC=CC(=C1)[N+](=O)[O-] |
Product Overview
Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester (CAS 85844-69-5), with molecular formula C19H30N2O6S and molecular weight 414.18 g/mol. IUPAC: ethyl 11-[(3-nitrophenyl)sulfonylamino]undecanoate.
Chemical Property Profile of Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester
Property Insights of Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester
The XLogP value of 3.9471 indicates that Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester 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 Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester. Following Lipinski's Rule of Five, Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester 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 Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester?
The CAS number of Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester is 85844-69-5.
What is the molecular formula of Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester?
The molecular formula of Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester is C19H30N2O6S.
What is the molecular weight of Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester?
The molecular weight of Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester is 414.18 g/mol.
Where can I buy Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester?
You can request a quote for Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Undecanoic acid, 11-(((3-nitrophenyl)sulfonyl)amino)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.