N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine
TL;DR: N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine (CAS 894760-54-4) is a chemical compound with molecular formula C13H11FN4O and molecular weight 258.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[5-(2-fluorophenyl)furan-2-yl]methyl]-1,2,4-triazol-4-amine
Also Known As: N-[[5-(2-fluorophenyl)furan-2-yl]methyl]-1,2,4-triazol-4-amine, N-{[5-(2-fluorophenyl)-2-furyl]methyl}-4H-1,2,4-triazol-4-amine, N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine, N-{[5-(2-fluorophenyl)furan-2-yl]methyl}-4H-1,2,4-triazol-4-amine
| Molecular Formula | C13H11FN4O |
|---|---|
| Molecular Weight | 258.09 g/mol |
| LogP | 2.4209 |
| Topological Polar Surface Area | 55.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.09167 |
| Heavy Atoms | 19 |
| Complexity | 662.8553 |
Chemical Identifiers
| CAS Number | 894760-54-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C2=CC=C(O2)CNN3C=NN=C3)F |
Product Overview
N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine (CAS 894760-54-4), with molecular formula C13H11FN4O and molecular weight 258.09 g/mol. IUPAC: N-[[5-(2-fluorophenyl)furan-2-yl]methyl]-1,2,4-triazol-4-amine.
Chemical Property Profile of N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine
Property Insights of N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine
The XLogP value of 2.4209 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine. With a topological polar surface area (TPSA) of 55.88 Ų, N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine has 1 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-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine?
The CAS number of N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine is 894760-54-4.
What is the molecular formula of N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine?
The molecular formula of N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine is C13H11FN4O.
What is the molecular weight of N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine?
The molecular weight of N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine is 258.09 g/mol.
Where can I buy N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine?
You can request a quote for N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-((5-(2-fluorophenyl)furan-2-yl)methyl)-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.