Hydroxystilbamidine Isethionate
TL;DR: Hydroxystilbamidine Isethionate (CAS 533-22-2) is a chemical compound with molecular formula C20H28N4O9S2 and molecular weight 532.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(4-carbamimidoylphenyl)ethenyl]-3-hydroxybenzenecarboximidamide;bis(2-hydroxyethanesulfonic acid)
Also Known As: Hydroxystilbamide, hydroxystilbamidine isethionate, ORTHO-TOLYLACETATE, 2-Hydroxystilbamidine diisethionate, Hydroxystilbamidine diisethionate
| Molecular Formula | C20H28N4O9S2 |
|---|---|
| Molecular Weight | 532.13 g/mol |
| LogP | -0.14 |
| Topological Polar Surface Area | 286.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 532.12976 |
| Heavy Atoms | 35 |
| Complexity | 530.0 |
Chemical Identifiers
| CAS Number | 533-22-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C=CC2=C(C=C(C=C2)C(=N)N)O)C(=N)N.C(CS(=O)(=O)O)O.C(CS(=O)(=O)O)O |
| InChIKey | XVTQTNAKZYLTNZ-UHFFFAOYSA-N |
Product Overview
Hydroxystilbamidine Isethionate (CAS 533-22-2), with molecular formula C20H28N4O9S2 and molecular weight 532.13 g/mol. IUPAC: 4-[2-(4-carbamimidoylphenyl)ethenyl]-3-hydroxybenzenecarboximidamide;bis(2-hydroxyethanesulfonic acid).
Chemical Property Profile of Hydroxystilbamidine Isethionate
Property Insights of Hydroxystilbamidine Isethionate
The XLogP value of -0.14 indicates that Hydroxystilbamidine Isethionate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 286.0 Ų indicates high polarity, suggesting Hydroxystilbamidine Isethionate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Hydroxystilbamidine Isethionate has 9 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Hydroxystilbamidine Isethionate?
The CAS number of Hydroxystilbamidine Isethionate is 533-22-2.
What is the molecular formula of Hydroxystilbamidine Isethionate?
The molecular formula of Hydroxystilbamidine Isethionate is C20H28N4O9S2.
What is the molecular weight of Hydroxystilbamidine Isethionate?
The molecular weight of Hydroxystilbamidine Isethionate is 532.13 g/mol.
Where can I buy Hydroxystilbamidine Isethionate?
You can request a quote for Hydroxystilbamidine Isethionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydroxystilbamidine Isethionate?
Yes, KEHONG BIO provides custom synthesis services for Hydroxystilbamidine Isethionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.