Sulfinalol HCl
TL;DR: Sulfinalol HCl (CAS 63251-39-8) is a chemical compound with molecular formula C20H28ClNO4S and molecular weight 413.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[1-hydroxy-2-[4-(4-methoxyphenyl)butan-2-ylamino]ethyl]-2-methylsulfinylphenol;hydrochloride
Also Known As: Sulfinalol HCl, SULFINALOL HYDROCHLORIDE, Win 40808-7, Sulfinalol (hydrochloride), Sulfinalol hydrochloride [USAN]
| Molecular Formula | C20H28ClNO4S |
|---|---|
| Molecular Weight | 413.14 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 413.14276 |
| Heavy Atoms | 27 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 63251-39-8 |
|---|---|
| SMILES | CC(CCC1=CC=C(C=C1)OC)NCC(C2=CC(=C(C=C2)O)S(=O)C)O.Cl |
| InChIKey | KJSMCQZGOIBBGM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Sulfinalol HCl (CAS 63251-39-8), with molecular formula C20H28ClNO4S and molecular weight 413.14 g/mol. IUPAC: 4-[1-hydroxy-2-[4-(4-methoxyphenyl)butan-2-ylamino]ethyl]-2-methylsulfinylphenol;hydrochloride.
Chemical Property Profile of Sulfinalol HCl
Property Insights of Sulfinalol HCl
The XLogP value of 3.2 indicates that Sulfinalol HCl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sulfinalol HCl. Following Lipinski's Rule of Five, Sulfinalol HCl has 4 hydrogen bond donor(s) and 6 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 Sulfinalol HCl?
The CAS number of Sulfinalol HCl is 63251-39-8.
What is the molecular formula of Sulfinalol HCl?
The molecular formula of Sulfinalol HCl is C20H28ClNO4S.
What is the molecular weight of Sulfinalol HCl?
The molecular weight of Sulfinalol HCl is 413.14 g/mol.
Where can I buy Sulfinalol HCl?
You can request a quote for Sulfinalol HCl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sulfinalol HCl?
Yes, KEHONG BIO provides custom synthesis services for Sulfinalol HCl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.