Succisulfone 2,2'-iminodiethanol salt
TL;DR: Succisulfone 2,2'-iminodiethanol salt (CAS 547-36-4) is a chemical compound with molecular formula C20H27N3O7S and molecular weight 453.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(4-aminophenyl)sulfonylanilino]-4-oxobutanoic acid;2-(2-hydroxyethylamino)ethanol
Also Known As: Succisulfona, Succisulfone, Succisulfonum, succisulfone diolamine, Succisulfone [INN:DCF]
| Molecular Formula | C20H27N3O7S |
|---|---|
| Molecular Weight | 453.16 g/mol |
| LogP | 0.47 |
| Topological Polar Surface Area | 187.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 453.15698 |
| Heavy Atoms | 31 |
| Complexity | 570.0 |
Chemical Identifiers
| CAS Number | 547-36-4 |
|---|---|
| SMILES | C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O.C(CO)NCCO |
| InChIKey | SAVXTCZPVGDUCR-UHFFFAOYSA-N |
Product Overview
Succisulfone 2,2'-iminodiethanol salt (CAS 547-36-4), with molecular formula C20H27N3O7S and molecular weight 453.16 g/mol. IUPAC: 4-[4-(4-aminophenyl)sulfonylanilino]-4-oxobutanoic acid;2-(2-hydroxyethylamino)ethanol.
Chemical Property Profile of Succisulfone 2,2'-iminodiethanol salt
Property Insights of Succisulfone 2,2'-iminodiethanol salt
The XLogP value of 0.47 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Succisulfone 2,2'-iminodiethanol salt. The TPSA of 187.0 Ų indicates high polarity, suggesting Succisulfone 2,2'-iminodiethanol salt may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Succisulfone 2,2'-iminodiethanol salt has 6 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Succisulfone 2,2'-iminodiethanol salt?
The CAS number of Succisulfone 2,2'-iminodiethanol salt is 547-36-4.
What is the molecular formula of Succisulfone 2,2'-iminodiethanol salt?
The molecular formula of Succisulfone 2,2'-iminodiethanol salt is C20H27N3O7S.
What is the molecular weight of Succisulfone 2,2'-iminodiethanol salt?
The molecular weight of Succisulfone 2,2'-iminodiethanol salt is 453.16 g/mol.
Where can I buy Succisulfone 2,2'-iminodiethanol salt?
You can request a quote for Succisulfone 2,2'-iminodiethanol salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Succisulfone 2,2'-iminodiethanol salt?
Yes, KEHONG BIO provides custom synthesis services for Succisulfone 2,2'-iminodiethanol salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.