5-Thiazolethiol
TL;DR: 5-Thiazolethiol (CAS 120405-09-6) is a chemical compound with molecular formula C3H3NS2 and molecular weight 116.97069 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-thiazole-5-thiol
Also Known As: 5-THIAZOLETHIOL, 1,3-thiazole-5-thiol, Thiazole-5-thiol, 1,3-thiazolium-5-thiolate
Technical Specifications
| Molecular Formula | C3H3NS2 |
| Molecular Weight | 116.97069 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 42.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 116.97069 Da |
| Heavy Atoms | 6 |
| Complexity | 48.0 |
| SMILES | C1=C(SC=N1)S |
| InChIKey | PKXGJLZKCTVTDR-UHFFFAOYSA-N |
Chemical Property Profile of 5-Thiazolethiol
Property Insights of 5-Thiazolethiol
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Thiazolethiol. With a topological polar surface area (TPSA) of 42.1 Ų, 5-Thiazolethiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Thiazolethiol 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
What is the CAS number of 5-Thiazolethiol?
The CAS number of 5-Thiazolethiol is 120405-09-6.
What is the molecular formula of 5-Thiazolethiol?
The molecular formula of 5-Thiazolethiol is C3H3NS2.
What is the molecular weight of 5-Thiazolethiol?
The molecular weight of 5-Thiazolethiol is 116.97069 g/mol.
Where can I buy 5-Thiazolethiol?
You can request a quote for 5-Thiazolethiol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Thiazolethiol?
Yes, CoreyChem provides custom synthesis services for 5-Thiazolethiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.