4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol
TL;DR: 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol (CAS 54063-56-8) is a chemical compound with molecular formula C20H35NOS and molecular weight 337.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(octylamino)-1-(4-propan-2-ylsulfanylphenyl)propan-1-ol
Also Known As: suloctidil, Suloctidyl, Sulodene, fluversin, loctidon
| Molecular Formula | C20H35NOS |
|---|---|
| Molecular Weight | 337.24 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 337.24393 |
| Heavy Atoms | 23 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 54063-56-8 |
|---|---|
| SMILES | CCCCCCCCNC(C)C(C1=CC=C(C=C1)SC(C)C)O |
| InChIKey | BFCDFTHTSVTWOG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol (CAS 54063-56-8), with molecular formula C20H35NOS and molecular weight 337.24 g/mol. IUPAC: 2-(octylamino)-1-(4-propan-2-ylsulfanylphenyl)propan-1-ol.
Chemical Property Profile of 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol
Property Insights of 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol
The XLogP value of 5.8 indicates that 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol?
The CAS number of 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol is 54063-56-8.
What is the molecular formula of 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol?
The molecular formula of 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol is C20H35NOS.
What is the molecular weight of 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol?
The molecular weight of 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol is 337.24 g/mol.
Where can I buy 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol?
You can request a quote for 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol?
Yes, KEHONG BIO provides custom synthesis services for 4-((1-Methylethyl)thio)-alpha-(1-(octylamino)ethyl)benzenemethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.