![2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole structure](/static/products/3374/337498-78-9.webp)
2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole
TL;DR: 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole (CAS 337498-78-9) is a chemical compound with molecular formula C10H6F3N3O2S2 and molecular weight 320.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole
Also Known As: BAS 01368638, 2-methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole, 2-methyl-5-((2-nitro-4-(trifluoromethyl)phenyl)thio)-1,3,4-thiadiazole, 2-Methyl-5-(2-nitro-4-trifluoromethyl-phenylsulfanyl)-[1,3,4]thiadiazole, 1-(5-methyl(1,3,4-thiadiazol-2-ylthio))-2-nitro-4-(trifluoromethyl)benzene
| Molecular Formula | C10H6F3N3O2S2 |
|---|---|
| Molecular Weight | 320.99 g/mol |
| LogP | 3.92472 |
| Topological Polar Surface Area | 68.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 320.98535 |
| Heavy Atoms | 20 |
| Complexity | 657.4376 |
Chemical Identifiers
| CAS Number | 337498-78-9 |
|---|---|
| SMILES | CC1=NN=C(S1)SC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-] |
Product Overview
2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole (CAS 337498-78-9), with molecular formula C10H6F3N3O2S2 and molecular weight 320.99 g/mol. IUPAC: 2-methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole.
Chemical Property Profile of 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole
Property Insights of 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole
The XLogP value of 3.92472 indicates that 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole. Following Lipinski's Rule of Five, 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole has 0 hydrogen bond donor(s) and 6 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 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole?
The CAS number of 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole is 337498-78-9.
What is the molecular formula of 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole?
The molecular formula of 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole is C10H6F3N3O2S2.
What is the molecular weight of 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole?
The molecular weight of 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole is 320.99 g/mol.
Where can I buy 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole?
You can request a quote for 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-5-[2-nitro-4-(trifluoromethyl)phenyl]sulfanyl-1,3,4-thiadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.