ST 558
TL;DR: ST 558 (CAS 116680-79-6) is a chemical compound with molecular formula C20H26ClNO4 and molecular weight 379.15503 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[2-[(6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-1-hydroxyethyl]phenol;hydrochloride
Also Known As: ST 558, 2-((N-2-p-Hydroxyphenyl-2-ethanol)amino)-6,7-dimethoxytetraline hydrochloride, Benzenemethanol, 4-hydroxy-alpha-(((1,2,3,4-tetrahydro-6,7-dimethoxy-2-naphthalenyl)amino)methyl)-, hydrochloride, 4-[2-[(6,7-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-1-hydroxyethyl]phenol hydrochloride, 4-{2-[(6,7-Dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl)amino]-1-hydroxyethyl}phenol--hydrogen chloride (1/1)
Technical Specifications
| Molecular Formula | C20H26ClNO4 |
| Molecular Weight | 379.15503 g/mol |
| XLogP | 3.0117 |
| Topological Polar Surface Area (TPSA) | 71.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 379.15503 Da |
| Heavy Atoms | 26 |
| Complexity | 399.0 |
| SMILES | COC1=C(C=C2CC(CCC2=C1)NCC(C3=CC=C(C=C3)O)O)OC.Cl |
| InChIKey | QVHILXRPYJKJRJ-UHFFFAOYSA-N |
Chemical Property Profile of ST 558
Property Insights of ST 558
The XLogP value of 3.0117 indicates that ST 558 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ST 558. Following Lipinski's Rule of Five, ST 558 has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of ST 558?
The CAS number of ST 558 is 116680-79-6.
What is the molecular formula of ST 558?
The molecular formula of ST 558 is C20H26ClNO4.
What is the molecular weight of ST 558?
The molecular weight of ST 558 is 379.15503 g/mol.
Where can I buy ST 558?
You can request a quote for ST 558 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ST 558?
Yes, CoreyChem provides custom synthesis services for ST 558 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.