![[2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate structure](/static/products/5598/5598-80-1.webp)
[2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate
TL;DR: [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate (CAS 5598-80-1) is a chemical compound with molecular formula C17H14Br2Cl2N2O5S and molecular weight 585.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate
Also Known As: [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate|2-(2,4-Dibromoanilino)-2-oxoethyl N-(2,6-dichlorobenzene-1-sulfonyl)-beta-alaninate
| Molecular Formula | C17H14Br2Cl2N2O5S |
|---|---|
| Molecular Weight | 585.84 g/mol |
| LogP | 4.3687 |
| Topological Polar Surface Area | 101.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 585.83673 |
| Heavy Atoms | 29 |
| Complexity | 1014.22845 |
Chemical Identifiers
| CAS Number | 5598-80-1 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)S(=O)(=O)NCCC(=O)OCC(=O)NC2=C(C=C(C=C2)Br)Br)Cl |
Product Overview
[2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate (CAS 5598-80-1), with molecular formula C17H14Br2Cl2N2O5S and molecular weight 585.84 g/mol. IUPAC: [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate.
Chemical Property Profile of [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate
Property Insights of [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate
The XLogP value of 4.3687 indicates that [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.57 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate. Following Lipinski's Rule of Five, [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate?
The CAS number of [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate is 5598-80-1.
What is the molecular formula of [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate?
The molecular formula of [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate is C17H14Br2Cl2N2O5S.
What is the molecular weight of [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate?
The molecular weight of [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate is 585.84 g/mol.
Where can I buy [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate?
You can request a quote for [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(2,4-dibromoanilino)-2-oxoethyl] 3-[(2,6-dichlorophenyl)sulfonylamino]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.