N-(4-fluorobenzyl)nicotinamide
TL;DR: N-(4-fluorobenzyl)nicotinamide (CAS 543705-90-4) is a chemical compound with molecular formula C13H11FN2O and molecular weight 230.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide
Also Known As: N-(4-fluorobenzyl)nicotinamide, N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide, N-(4-fluorobenzyl)pyridine-3-carboxamide, N-[(4-fluorophenyl)methyl]-3-pyridylcarboxamide, AN-652/12973913
| Molecular Formula | C13H11FN2O |
|---|---|
| Molecular Weight | 230.09 g/mol |
| LogP | 2.1507 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.08554 |
| Heavy Atoms | 17 |
| Complexity | 496.58774 |
Chemical Identifiers
| CAS Number | 543705-90-4 |
|---|---|
| SMILES | C1=CC(=CN=C1)C(=O)NCC2=CC=C(C=C2)F |
Product Overview
N-(4-fluorobenzyl)nicotinamide (CAS 543705-90-4), with molecular formula C13H11FN2O and molecular weight 230.09 g/mol. IUPAC: N-[(4-fluorophenyl)methyl]pyridine-3-carboxamide.
Chemical Property Profile of N-(4-fluorobenzyl)nicotinamide
Property Insights of N-(4-fluorobenzyl)nicotinamide
The XLogP value of 2.1507 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-fluorobenzyl)nicotinamide. With a topological polar surface area (TPSA) of 41.99 Ų, N-(4-fluorobenzyl)nicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-fluorobenzyl)nicotinamide 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 N-(4-fluorobenzyl)nicotinamide?
The CAS number of N-(4-fluorobenzyl)nicotinamide is 543705-90-4.
What is the molecular formula of N-(4-fluorobenzyl)nicotinamide?
The molecular formula of N-(4-fluorobenzyl)nicotinamide is C13H11FN2O.
What is the molecular weight of N-(4-fluorobenzyl)nicotinamide?
The molecular weight of N-(4-fluorobenzyl)nicotinamide is 230.09 g/mol.
Where can I buy N-(4-fluorobenzyl)nicotinamide?
You can request a quote for N-(4-fluorobenzyl)nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-fluorobenzyl)nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-fluorobenzyl)nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.