N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide
TL;DR: N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide (CAS 499227-55-3) is a chemical compound with molecular formula C8H5F3N4O2 and molecular weight 246.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]furan-2-carboxamide
Also Known As: N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide, N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]furan-2-carboxamide, 2-Furancarboxamide, N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]- (9CI)
| Molecular Formula | C8H5F3N4O2 |
|---|---|
| Molecular Weight | 246.04 g/mol |
| LogP | 1.6688 |
| Topological Polar Surface Area | 83.81 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.03645 |
| Heavy Atoms | 17 |
| Complexity | 517.11273 |
Chemical Identifiers
| CAS Number | 499227-55-3 |
|---|---|
| SMILES | C1=COC(=C1)C(=O)NC2=NNC(=N2)C(F)(F)F |
Product Overview
N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide (CAS 499227-55-3), with molecular formula C8H5F3N4O2 and molecular weight 246.04 g/mol. IUPAC: N-[5-(trifluoromethyl)-1H-1,2,4-triazol-3-yl]furan-2-carboxamide.
Chemical Property Profile of N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide
Property Insights of N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide
The XLogP value of 1.6688 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide. The TPSA of 83.81 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide. Following Lipinski's Rule of Five, N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide has 2 hydrogen bond donor(s) and 4 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)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide?
The CAS number of N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide is 499227-55-3.
What is the molecular formula of N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide?
The molecular formula of N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide is C8H5F3N4O2.
What is the molecular weight of N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide?
The molecular weight of N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide is 246.04 g/mol.
Where can I buy N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide?
You can request a quote for N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide 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)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(5-(Trifluoromethyl)-1H-1,2,4-triazol-3-yl)furan-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.