![N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine structure](/static/products/894/894862-22-7.png)
N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine
TL;DR: N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine (CAS 894862-22-7) is a chemical compound with molecular formula C16H15FN4O and molecular weight 298.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2,4-triazol-4-amine
Also Known As: N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine, AN-465/40854083, N-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2,4-triazol-4-amine, N-{3-[(4-fluorobenzyl)oxy]benzyl}-N-(4H-1,2,4-triazol-4-yl)amine
| Molecular Formula | C16H15FN4O |
|---|---|
| Molecular Weight | 298.12 g/mol |
| LogP | 2.7399 |
| Topological Polar Surface Area | 51.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.123 |
| Heavy Atoms | 22 |
| Complexity | 713.27545 |
Chemical Identifiers
| CAS Number | 894862-22-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OCC2=CC=C(C=C2)F)CNN3C=NN=C3 |
Product Overview
N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine (CAS 894862-22-7), with molecular formula C16H15FN4O and molecular weight 298.12 g/mol. IUPAC: N-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]-1,2,4-triazol-4-amine.
Chemical Property Profile of N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine
Property Insights of N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine
The XLogP value of 2.7399 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine. With a topological polar surface area (TPSA) of 51.97 Ų, N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{3-[(4-fluorobenzyl)oxy]benzyl}-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-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine?
The CAS number of N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine is 894862-22-7.
What is the molecular formula of N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine?
The molecular formula of N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine is C16H15FN4O.
What is the molecular weight of N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine?
The molecular weight of N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine is 298.12 g/mol.
Where can I buy N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine?
You can request a quote for N-{3-[(4-fluorobenzyl)oxy]benzyl}-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-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for N-{3-[(4-fluorobenzyl)oxy]benzyl}-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.