![4-cyano-N-[(4-fluorophenyl)methyl]benzamide structure](/static/products/5121/512181-82-7.webp)
4-cyano-N-[(4-fluorophenyl)methyl]benzamide
TL;DR: 4-cyano-N-[(4-fluorophenyl)methyl]benzamide (CAS 512181-82-7) is a chemical compound with molecular formula C15H11FN2O and molecular weight 254.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-cyano-N-[(4-fluorophenyl)methyl]benzamide
Also Known As: 4-cyano-N-(4-fluorobenzyl)benzamide, 4-cyano-N-[(4-fluorophenyl)methyl]benzamide, n-(4-fluorobenzyl)-4-cyanobenzamide, J3.509.062B
| Molecular Formula | C15H11FN2O |
|---|---|
| Molecular Weight | 254.09 g/mol |
| LogP | 2.62738 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 254.08554 |
| Heavy Atoms | 19 |
| Complexity | 612.089 |
Chemical Identifiers
| CAS Number | 512181-82-7 |
|---|---|
| SMILES | C1=CC(=CC=C1CNC(=O)C2=CC=C(C=C2)C#N)F |
Product Overview
4-cyano-N-[(4-fluorophenyl)methyl]benzamide (CAS 512181-82-7), with molecular formula C15H11FN2O and molecular weight 254.09 g/mol. IUPAC: 4-cyano-N-[(4-fluorophenyl)methyl]benzamide.
Chemical Property Profile of 4-cyano-N-[(4-fluorophenyl)methyl]benzamide
Property Insights of 4-cyano-N-[(4-fluorophenyl)methyl]benzamide
The XLogP value of 2.62738 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-cyano-N-[(4-fluorophenyl)methyl]benzamide. With a topological polar surface area (TPSA) of 52.89 Ų, 4-cyano-N-[(4-fluorophenyl)methyl]benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-cyano-N-[(4-fluorophenyl)methyl]benzamide 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-cyano-N-[(4-fluorophenyl)methyl]benzamide?
The CAS number of 4-cyano-N-[(4-fluorophenyl)methyl]benzamide is 512181-82-7.
What is the molecular formula of 4-cyano-N-[(4-fluorophenyl)methyl]benzamide?
The molecular formula of 4-cyano-N-[(4-fluorophenyl)methyl]benzamide is C15H11FN2O.
What is the molecular weight of 4-cyano-N-[(4-fluorophenyl)methyl]benzamide?
The molecular weight of 4-cyano-N-[(4-fluorophenyl)methyl]benzamide is 254.09 g/mol.
Where can I buy 4-cyano-N-[(4-fluorophenyl)methyl]benzamide?
You can request a quote for 4-cyano-N-[(4-fluorophenyl)methyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-cyano-N-[(4-fluorophenyl)methyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-cyano-N-[(4-fluorophenyl)methyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.