![4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile structure](/static/products/797/797769-58-5.png)
4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile
TL;DR: 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile (CAS 797769-58-5) is a chemical compound with molecular formula C15H13FN2 and molecular weight 240.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(4-fluorophenyl)methylamino]methyl]benzonitrile
Also Known As: BAS 08261870, 4-({[(4-FLUOROPHENYL)METHYL]AMINO}METHYL)BENZONITRILE, 4-(((4-Fluorobenzyl)amino)methyl)benzonitrile, 4-[[(4-fluorophenyl)methylamino]methyl]benzonitrile, 4-[(4-Fluoro-benzylamino)-methyl]-benzonitrile
| Molecular Formula | C15H13FN2 |
|---|---|
| Molecular Weight | 240.11 g/mol |
| LogP | 2.98718 |
| Topological Polar Surface Area | 35.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.10628 |
| Heavy Atoms | 18 |
| Complexity | 538.2014 |
Chemical Identifiers
| CAS Number | 797769-58-5 |
|---|---|
| SMILES | C1=CC(=CC=C1CNCC2=CC=C(C=C2)F)C#N |
Product Overview
4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile (CAS 797769-58-5), with molecular formula C15H13FN2 and molecular weight 240.11 g/mol. IUPAC: 4-[[(4-fluorophenyl)methylamino]methyl]benzonitrile.
Chemical Property Profile of 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile
Property Insights of 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile
The XLogP value of 2.98718 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile. With a topological polar surface area (TPSA) of 35.82 Ų, 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile has 1 hydrogen bond donor(s) and 2 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 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile?
The CAS number of 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile is 797769-58-5.
What is the molecular formula of 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile?
The molecular formula of 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile is C15H13FN2.
What is the molecular weight of 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile?
The molecular weight of 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile is 240.11 g/mol.
Where can I buy 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile?
You can request a quote for 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-({[(4-Fluorophenyl)methyl]amino}methyl)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.