硫氧洛尔
TL;DR: 硫氧洛尔 (CAS 66264-77-5) is a chemical compound with molecular formula C20H27NO4S and molecular weight 377.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
硫氧洛尔
4-[1-hydroxy-2-[4-(4-methoxyphenyl)butan-2-ylamino]ethyl]-2-methylsulfinylphenol
Also Known As: Sulfinalolum, Sulfinalol [INN], Sulfinalol HCl, Sulfinalolum [INN-Latin], SULFINALOL [MI]
| Molecular Formula | C20H27NO4S |
|---|---|
| Molecular Weight | 377.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 98.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 377.16608 |
| Heavy Atoms | 26 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 66264-77-5 |
|---|---|
| SMILES | CC(CCC1=CC=C(C=C1)OC)NCC(C2=CC(=C(C=C2)O)S(=O)C)O |
| InChIKey | PAQZZCOZHPGCFW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
硫氧洛尔 (CAS 66264-77-5), with molecular formula C20H27NO4S and molecular weight 377.17 g/mol. IUPAC: 4-[1-hydroxy-2-[4-(4-methoxyphenyl)butan-2-ylamino]ethyl]-2-methylsulfinylphenol.
Chemical Property Profile of 硫氧洛尔
Property Insights of 硫氧洛尔
The XLogP value of 3.3 indicates that 硫氧洛尔 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 硫氧洛尔. Following Lipinski's Rule of Five, 硫氧洛尔 has 3 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 硫氧洛尔?
The CAS number of 硫氧洛尔 is 66264-77-5.
What is the molecular formula of 硫氧洛尔?
The molecular formula of 硫氧洛尔 is C20H27NO4S.
What is the molecular weight of 硫氧洛尔?
The molecular weight of 硫氧洛尔 is 377.17 g/mol.
Where can I buy 硫氧洛尔?
You can request a quote for 硫氧洛尔 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 硫氧洛尔?
Yes, KEHONG BIO provides custom synthesis services for 硫氧洛尔 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.