![4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide structure](/static/products/716/716331-76-9.png)
4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
TL;DR: 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide (CAS 716331-76-9) is a chemical compound with molecular formula C16H17F3N6O2S and molecular weight 414.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
Also Known As: 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide, 4-oxo-4-(4-(pyridin-2-yl)piperazin-1-yl)-N-(5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl)butanamide, 4-Oxo-4-(4-pyridin-2-yl-piperazin-1-yl)-N-(5-trifluoromethyl-[1,3,4]thiadiazol-2-yl)-butyramide
| Molecular Formula | C16H17F3N6O2S |
|---|---|
| Molecular Weight | 414.11 g/mol |
| LogP | 2.0194 |
| Topological Polar Surface Area | 91.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.10858 |
| Heavy Atoms | 28 |
| Complexity | 821.2871 |
Chemical Identifiers
| CAS Number | 716331-76-9 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=N2)C(=O)CCC(=O)NC3=NN=C(S3)C(F)(F)F |
Product Overview
4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide (CAS 716331-76-9), with molecular formula C16H17F3N6O2S and molecular weight 414.11 g/mol. IUPAC: 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide.
Chemical Property Profile of 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
Property Insights of 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide
The XLogP value of 2.0194 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide. The TPSA of 91.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide. Following Lipinski's Rule of Five, 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide 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 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide?
The CAS number of 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide is 716331-76-9.
What is the molecular formula of 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide?
The molecular formula of 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide is C16H17F3N6O2S.
What is the molecular weight of 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide?
The molecular weight of 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide is 414.11 g/mol.
Where can I buy 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide?
You can request a quote for 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide?
Yes, KEHONG BIO provides custom synthesis services for 4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)-N-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.