RefChem:571032
TL;DR: RefChem:571032 (CAS 65277-52-3) is a chemical compound with molecular formula C17H27NNa2O8S and molecular weight 451.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;4-oxo-3-sulfonato-4-[2-(undec-10-enoylamino)ethoxy]butanoate
Also Known As: Disodium 1-(undecylenic monoethanolamide) sulfosuccinate, Butanedioic acid, 2-sulfo-, 1-(2-((1-oxo-10-undecen-1-yl)amino)ethyl) ester, sodium salt (1:2), disodium1-[2-[ amino]ethyl]2-sulphonatosuccinate, Disodium 1-(2-((1-oxoundec-10-enyl)amino)ethyl) 2-sulphonatosuccinate, Butanedioic acid, sulfo-, 1-(2-((1-oxo-10-undecenyl)amino)ethyl) ester, disodium salt
| Molecular Formula | C17H27NNa2O8S |
|---|---|
| Molecular Weight | 451.13 g/mol |
| LogP | -5.9856 |
| Topological Polar Surface Area | 161.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 15 |
| Exact Mass | 451.12527 |
| Heavy Atoms | 29 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 65277-52-3 |
|---|---|
| SMILES | C=CCCCCCCCCC(=O)NCCOC(=O)C(CC(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+] |
| InChIKey | HQWDESXVUSWTPT-UHFFFAOYSA-L |
Product Overview
RefChem:571032 (CAS 65277-52-3), with molecular formula C17H27NNa2O8S and molecular weight 451.13 g/mol. IUPAC: disodium;4-oxo-3-sulfonato-4-[2-(undec-10-enoylamino)ethoxy]butanoate.
Chemical Property Profile of RefChem:571032
Property Insights of RefChem:571032
The XLogP value of -5.9856 indicates that RefChem:571032 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 161.0 Ų indicates high polarity, suggesting RefChem:571032 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:571032 has 1 hydrogen bond donor(s) and 8 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 RefChem:571032?
The CAS number of RefChem:571032 is 65277-52-3.
What is the molecular formula of RefChem:571032?
The molecular formula of RefChem:571032 is C17H27NNa2O8S.
What is the molecular weight of RefChem:571032?
The molecular weight of RefChem:571032 is 451.13 g/mol.
Where can I buy RefChem:571032?
You can request a quote for RefChem:571032 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:571032?
Yes, KEHONG BIO provides custom synthesis services for RefChem:571032 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.