N-(4-butylphenyl)-4-cyano-2-fluorobenzamide
TL;DR: N-(4-butylphenyl)-4-cyano-2-fluorobenzamide (CAS 445414-11-9) is a chemical compound with molecular formula C18H17FN2O and molecular weight 296.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-butylphenyl)-4-cyano-2-fluorobenzamide
Also Known As: N-(4-butylphenyl)-4-cyano-2-fluorobenzamide, AN-465/40934168
| Molecular Formula | C18H17FN2O |
|---|---|
| Molecular Weight | 296.13 g/mol |
| LogP | 4.29228 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.13248 |
| Heavy Atoms | 22 |
| Complexity | 702.01733 |
Chemical Identifiers
| CAS Number | 445414-11-9 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)NC(=O)C2=C(C=C(C=C2)C#N)F |
Product Overview
N-(4-butylphenyl)-4-cyano-2-fluorobenzamide (CAS 445414-11-9), with molecular formula C18H17FN2O and molecular weight 296.13 g/mol. IUPAC: N-(4-butylphenyl)-4-cyano-2-fluorobenzamide.
Chemical Property Profile of N-(4-butylphenyl)-4-cyano-2-fluorobenzamide
Property Insights of N-(4-butylphenyl)-4-cyano-2-fluorobenzamide
The XLogP value of 4.29228 indicates that N-(4-butylphenyl)-4-cyano-2-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, N-(4-butylphenyl)-4-cyano-2-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-butylphenyl)-4-cyano-2-fluorobenzamide 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-butylphenyl)-4-cyano-2-fluorobenzamide?
The CAS number of N-(4-butylphenyl)-4-cyano-2-fluorobenzamide is 445414-11-9.
What is the molecular formula of N-(4-butylphenyl)-4-cyano-2-fluorobenzamide?
The molecular formula of N-(4-butylphenyl)-4-cyano-2-fluorobenzamide is C18H17FN2O.
What is the molecular weight of N-(4-butylphenyl)-4-cyano-2-fluorobenzamide?
The molecular weight of N-(4-butylphenyl)-4-cyano-2-fluorobenzamide is 296.13 g/mol.
Where can I buy N-(4-butylphenyl)-4-cyano-2-fluorobenzamide?
You can request a quote for N-(4-butylphenyl)-4-cyano-2-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-butylphenyl)-4-cyano-2-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-butylphenyl)-4-cyano-2-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.