4-(4-Fluorophenyl)-1,3-thiazole-2-thiol
TL;DR: 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol (CAS 42838-37-9) is a chemical compound with molecular formula C9H6FNS2 and molecular weight 210.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-fluorophenyl)-3H-1,3-thiazole-2-thione
Also Known As: 4-(4-fluorophenyl)-1,3-thiazole-2-thiol, 4-(4-fluorophenyl)thiazole-2-thiol, 2-thiazolethiol, 4-(4-fluorophenyl)-, 4-(4-fluorophenyl)-3H-1,3-thiazole-2-thione, 4-(4-fluorophenyl)-3H-thiazole-2-thione
| Molecular Formula | C9H6FNS2 |
|---|---|
| Molecular Weight | 210.99 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 69.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.99257 |
| Heavy Atoms | 13 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 42838-37-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=CSC(=S)N2)F |
| InChIKey | MWMWTZPSWBGHNI-UHFFFAOYSA-N |
Product Overview
4-(4-Fluorophenyl)-1,3-thiazole-2-thiol (CAS 42838-37-9), with molecular formula C9H6FNS2 and molecular weight 210.99 g/mol. IUPAC: 4-(4-fluorophenyl)-3H-1,3-thiazole-2-thione.
Chemical Property Profile of 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol
Property Insights of 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol. The TPSA of 69.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol. Following Lipinski's Rule of Five, 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol has 1 hydrogen bond donor(s) and 3 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-(4-Fluorophenyl)-1,3-thiazole-2-thiol?
The CAS number of 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol is 42838-37-9.
What is the molecular formula of 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol?
The molecular formula of 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol is C9H6FNS2.
What is the molecular weight of 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol?
The molecular weight of 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol is 210.99 g/mol.
Where can I buy 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol?
You can request a quote for 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Fluorophenyl)-1,3-thiazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.