2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide
TL;DR: 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide (CAS 70501-47-2) is a chemical compound with molecular formula C6H3F7N4O and molecular weight 280.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,3,3,4,4,4-heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide
Also Known As: 2,2,3,3,4,4,4-heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide, 2,2,3,3,4,4,4-heptafluoro-N-(1H-1,2,4-triazol-3-yl)butanamide, RefChem:242592
| Molecular Formula | C6H3F7N4O |
|---|---|
| Molecular Weight | 280.02 g/mol |
| LogP | 1.5761 |
| Topological Polar Surface Area | 70.67 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 280.0195 |
| Heavy Atoms | 18 |
| Complexity | 425.64413 |
Chemical Identifiers
| CAS Number | 70501-47-2 |
|---|---|
| SMILES | C1=NNC(=N1)NC(=O)C(C(C(F)(F)F)(F)F)(F)F |
Product Overview
2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide (CAS 70501-47-2), with molecular formula C6H3F7N4O and molecular weight 280.02 g/mol. IUPAC: 2,2,3,3,4,4,4-heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide.
Chemical Property Profile of 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide
Property Insights of 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide
The XLogP value of 1.5761 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide. The TPSA of 70.67 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide. Following Lipinski's Rule of Five, 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide has 2 hydrogen bond donor(s) and 3 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 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide?
The CAS number of 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide is 70501-47-2.
What is the molecular formula of 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide?
The molecular formula of 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide is C6H3F7N4O.
What is the molecular weight of 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide?
The molecular weight of 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide is 280.02 g/mol.
Where can I buy 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide?
You can request a quote for 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 2,2,3,3,4,4,4-Heptafluoro-N-(1H-1,2,4-triazol-5-yl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.