4-(4-Fluorobenzyl)thiomorpholine
TL;DR: 4-(4-Fluorobenzyl)thiomorpholine (CAS 1542-56-9) is a chemical compound with molecular formula C11H14FNS and molecular weight 211.0831 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4-fluorophenyl)methyl]thiomorpholine
Also Known As: 4-(4-Fluorobenzyl)thiomorpholine, 4-[(4-fluorophenyl)methyl]thiomorpholine, N-(4-Fluor-benzyl)-thiomorpholin, 4-(4-fluoro-benzyl)-thiomorpholine, AB00077687-01
Technical Specifications
| Molecular Formula | C11H14FNS |
| Molecular Weight | 211.0831 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 28.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.0831 Da |
| Heavy Atoms | 14 |
| Complexity | 163.0 |
| SMILES | C1CSCCN1CC2=CC=C(C=C2)F |
| InChIKey | AYGBTECRJAHBKF-UHFFFAOYSA-N |
Chemical Property Profile of 4-(4-Fluorobenzyl)thiomorpholine
Property Insights of 4-(4-Fluorobenzyl)thiomorpholine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Fluorobenzyl)thiomorpholine. With a topological polar surface area (TPSA) of 28.5 Ų, 4-(4-Fluorobenzyl)thiomorpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Fluorobenzyl)thiomorpholine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(4-Fluorobenzyl)thiomorpholine?
The CAS number of 4-(4-Fluorobenzyl)thiomorpholine is 1542-56-9.
What is the molecular formula of 4-(4-Fluorobenzyl)thiomorpholine?
The molecular formula of 4-(4-Fluorobenzyl)thiomorpholine is C11H14FNS.
What is the molecular weight of 4-(4-Fluorobenzyl)thiomorpholine?
The molecular weight of 4-(4-Fluorobenzyl)thiomorpholine is 211.0831 g/mol.
Where can I buy 4-(4-Fluorobenzyl)thiomorpholine?
You can request a quote for 4-(4-Fluorobenzyl)thiomorpholine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(4-Fluorobenzyl)thiomorpholine?
Yes, CoreyChem provides custom synthesis services for 4-(4-Fluorobenzyl)thiomorpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.