4-(Ethylthio)-3'-fluorobenzhydrol
TL;DR: 4-(Ethylthio)-3'-fluorobenzhydrol (CAS 844683-71-2) is a chemical compound with molecular formula C15H15FOS and molecular weight 262.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-ethylsulfanylphenyl)-(3-fluorophenyl)methanol
Also Known As: 4-(Ethylthio)-3'-fluorobenzhydrol, (4-(Ethylthio)phenyl)(3-fluorophenyl)methanol, (4-ethylsulfanylphenyl)-(3-fluorophenyl)methanol
| Molecular Formula | C15H15FOS |
|---|---|
| Molecular Weight | 262.08 g/mol |
| LogP | 4.0194 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.08276 |
| Heavy Atoms | 18 |
| Complexity | 510.15698 |
Chemical Identifiers
| CAS Number | 844683-71-2 |
|---|---|
| SMILES | CCSC1=CC=C(C=C1)C(C2=CC(=CC=C2)F)O |
Product Overview
4-(Ethylthio)-3'-fluorobenzhydrol (CAS 844683-71-2), with molecular formula C15H15FOS and molecular weight 262.08 g/mol. IUPAC: (4-ethylsulfanylphenyl)-(3-fluorophenyl)methanol.
Chemical Property Profile of 4-(Ethylthio)-3'-fluorobenzhydrol
Property Insights of 4-(Ethylthio)-3'-fluorobenzhydrol
The XLogP value of 4.0194 indicates that 4-(Ethylthio)-3'-fluorobenzhydrol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, 4-(Ethylthio)-3'-fluorobenzhydrol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Ethylthio)-3'-fluorobenzhydrol has 1 hydrogen bond donor(s) and 2 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 4-(Ethylthio)-3'-fluorobenzhydrol?
The CAS number of 4-(Ethylthio)-3'-fluorobenzhydrol is 844683-71-2.
What is the molecular formula of 4-(Ethylthio)-3'-fluorobenzhydrol?
The molecular formula of 4-(Ethylthio)-3'-fluorobenzhydrol is C15H15FOS.
What is the molecular weight of 4-(Ethylthio)-3'-fluorobenzhydrol?
The molecular weight of 4-(Ethylthio)-3'-fluorobenzhydrol is 262.08 g/mol.
Where can I buy 4-(Ethylthio)-3'-fluorobenzhydrol?
You can request a quote for 4-(Ethylthio)-3'-fluorobenzhydrol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Ethylthio)-3'-fluorobenzhydrol?
Yes, KEHONG BIO provides custom synthesis services for 4-(Ethylthio)-3'-fluorobenzhydrol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.