![5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol structure](/static/products/883/883041-73-4.png)
5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol
TL;DR: 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol (CAS 883041-73-4) is a chemical compound with molecular formula C9H6F3N3OS2 and molecular weight 292.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[4-(trifluoromethoxy)anilino]-3H-1,3,4-thiadiazole-2-thione
Also Known As: 5-{[4-(trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol, Maybridge4_003857, 5-[4-(trifluoromethoxy)anilino]-3H-1,3,4-thiadiazole-2-thione, BRD-K52478588-001-01-8, BRD-K52478588-001-03-4
| Molecular Formula | C9H6F3N3OS2 |
|---|---|
| Molecular Weight | 292.99 g/mol |
| LogP | 3.84289 |
| Topological Polar Surface Area | 49.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.99045 |
| Heavy Atoms | 18 |
| Complexity | 575.7341 |
Chemical Identifiers
| CAS Number | 883041-73-4 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=NNC(=S)S2)OC(F)(F)F |
Product Overview
5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol (CAS 883041-73-4), with molecular formula C9H6F3N3OS2 and molecular weight 292.99 g/mol. IUPAC: 5-[4-(trifluoromethoxy)anilino]-3H-1,3,4-thiadiazole-2-thione.
Chemical Property Profile of 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol
Property Insights of 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol
The XLogP value of 3.84289 indicates that 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.94 Ų, 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol has 2 hydrogen bond donor(s) and 5 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 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol?
The CAS number of 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol is 883041-73-4.
What is the molecular formula of 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol?
The molecular formula of 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol is C9H6F3N3OS2.
What is the molecular weight of 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol?
The molecular weight of 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol is 292.99 g/mol.
Where can I buy 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol?
You can request a quote for 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol?
Yes, KEHONG BIO provides custom synthesis services for 5-{[4-(Trifluoromethoxy)phenyl]amino}-1,3,4-thiadiazole-2-thiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.