N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine
TL;DR: N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine (CAS 861235-82-7) is a chemical compound with molecular formula C15H14FN5O and molecular weight 299.12 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]-2H-tetrazol-5-amine
Also Known As: AN-465/41587333, N-{3-[(4-fluorobenzyl)oxy]benzyl}-2H-tetrazol-5-amine, N-(3-((4-fluorobenzyl)oxy)benzyl)-2H-tetrazol-5-amine, N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine, N-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]-2H-tetrazol-5-amine
| Molecular Formula | C15H14FN5O |
|---|---|
| Molecular Weight | 299.12 g/mol |
| LogP | 2.5299 |
| Topological Polar Surface Area | 75.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 299.11823 |
| Heavy Atoms | 22 |
| Complexity | 715.06244 |
Chemical Identifiers
| CAS Number | 861235-82-7 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OCC2=CC=C(C=C2)F)CNC3=NNN=N3 |
Product Overview
N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine (CAS 861235-82-7), with molecular formula C15H14FN5O and molecular weight 299.12 g/mol. IUPAC: N-[[3-[(4-fluorophenyl)methoxy]phenyl]methyl]-2H-tetrazol-5-amine.
Chemical Property Profile of N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine
Property Insights of N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine
The XLogP value of 2.5299 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine. The TPSA of 75.72 Ų falls within the moderate polarity range, balancing permeability and solubility for N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine. Following Lipinski's Rule of Five, N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine has 2 hydrogen bond donor(s) and 5 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}-1H-tetrazol-5-amine?
The CAS number of N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine is 861235-82-7.
What is the molecular formula of N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine?
The molecular formula of N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine is C15H14FN5O.
What is the molecular weight of N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine?
The molecular weight of N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine is 299.12 g/mol.
Where can I buy N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine?
You can request a quote for N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-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}-1H-tetrazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for N-{3-[(4-fluorobenzyl)oxy]benzyl}-1H-tetrazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.