![N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide structure](/static/products/5404/54047-24-4.webp)
N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
TL;DR: N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide (CAS 54047-24-4) is a chemical compound with molecular formula C10H6F3N3OS and molecular weight 273.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide, BAS 05023370, A0657/0030531, N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)benzamide, N-(5-Trifluoromethyl-[1,3,4]thiadiazol-2-yl)-benzamide
| Molecular Formula | C10H6F3N3OS |
|---|---|
| Molecular Weight | 273.02 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.01837 |
| Heavy Atoms | 18 |
| Complexity | 307.0 |
Chemical Identifiers
| CAS Number | 54047-24-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NC2=NN=C(S2)C(F)(F)F |
| InChIKey | FKRDLJBIMKZEST-UHFFFAOYSA-N |
Product Overview
N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide (CAS 54047-24-4), with molecular formula C10H6F3N3OS and molecular weight 273.02 g/mol. IUPAC: N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide.
Chemical Property Profile of N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
Property Insights of N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide. Following Lipinski's Rule of Five, N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide has 1 hydrogen bond donor(s) and 7 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 N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide?
The CAS number of N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide is 54047-24-4.
What is the molecular formula of N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide?
The molecular formula of N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide is C10H6F3N3OS.
What is the molecular weight of N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide?
The molecular weight of N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide is 273.02 g/mol.
Where can I buy N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide?
You can request a quote for N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.