Persilate
TL;DR: Persilate (CAS 6375-65-1) is a chemical compound with molecular formula C14H28N2O8S2 and molecular weight 416.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dihydroxybenzene-1,4-disulfonic acid;bis(N-ethylethanamine)
Also Known As: Persilate, 2-[(2-nitrophenyl)sulfanyl]acetic acid, Calcium Dobesilate Impurity 4 (Diethylamine Salt), 2,5-dihydroxybenzene-1,4-disulfonic acid;N-ethylethanamine, Calcium Dobesilate Impurity N4 Bis-diethylamine Salt
| Molecular Formula | C14H28N2O8S2 |
|---|---|
| Molecular Weight | 416.13 g/mol |
| LogP | 0.8228 |
| Topological Polar Surface Area | 190.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 416.12872 |
| Heavy Atoms | 26 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 6375-65-1 |
|---|---|
| SMILES | CCNCC.CCNCC.C1=C(C(=CC(=C1S(=O)(=O)O)O)S(=O)(=O)O)O |
| InChIKey | XYUSESXYUHHDPC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Persilate (CAS 6375-65-1), with molecular formula C14H28N2O8S2 and molecular weight 416.13 g/mol. IUPAC: 2,5-dihydroxybenzene-1,4-disulfonic acid;bis(N-ethylethanamine).
Chemical Property Profile of Persilate
Property Insights of Persilate
The XLogP value of 0.8228 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Persilate. The TPSA of 190.0 Ų indicates high polarity, suggesting Persilate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Persilate has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Persilate?
The CAS number of Persilate is 6375-65-1.
What is the molecular formula of Persilate?
The molecular formula of Persilate is C14H28N2O8S2.
What is the molecular weight of Persilate?
The molecular weight of Persilate is 416.13 g/mol.
Where can I buy Persilate?
You can request a quote for Persilate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Persilate?
Yes, KEHONG BIO provides custom synthesis services for Persilate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.