![1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine structure](/static/products/694/694468-01-4.png)
1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine
TL;DR: 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine (CAS 694468-01-4) is a chemical compound with molecular formula C12H12F3N5S and molecular weight 315.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-pyridin-2-ylpiperazin-1-yl)-5-(trifluoromethyl)-1,3,4-thiadiazole
Also Known As: VU0048242-1, 1-(2-pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine, 1-(pyridin-2-yl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine, 2-(4-(pyridin-2-yl)piperazin-1-yl)-5-(trifluoromethyl)-1,3,4-thiadiazole, 2-(4-pyridin-2-ylpiperazin-1-yl)-5-(trifluoromethyl)-1,3,4-thiadiazole
| Molecular Formula | C12H12F3N5S |
|---|---|
| Molecular Weight | 315.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 73.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 315.07654 |
| Heavy Atoms | 21 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 694468-01-4 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=N2)C3=NN=C(S3)C(F)(F)F |
| InChIKey | HCIJFQGJVAFWCF-UHFFFAOYSA-N |
Product Overview
1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine (CAS 694468-01-4), with molecular formula C12H12F3N5S and molecular weight 315.08 g/mol. IUPAC: 2-(4-pyridin-2-ylpiperazin-1-yl)-5-(trifluoromethyl)-1,3,4-thiadiazole.
Chemical Property Profile of 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine
Property Insights of 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine. The TPSA of 73.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine. Following Lipinski's Rule of Five, 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine has 0 hydrogen bond donor(s) and 9 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 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine?
The CAS number of 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine is 694468-01-4.
What is the molecular formula of 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine?
The molecular formula of 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine is C12H12F3N5S.
What is the molecular weight of 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine?
The molecular weight of 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine is 315.08 g/mol.
Where can I buy 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine?
You can request a quote for 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Pyridinyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.