N-(4-bromophenyl)-4-cyano-2-fluorobenzamide
TL;DR: N-(4-bromophenyl)-4-cyano-2-fluorobenzamide (CAS 842115-60-0) is a chemical compound with molecular formula C14H8BrFN2O and molecular weight 317.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-4-cyano-2-fluorobenzamide
Also Known As: N-(4-bromophenyl)-4-cyano-2-fluorobenzamide
| Molecular Formula | C14H8BrFN2O |
|---|---|
| Molecular Weight | 317.98 g/mol |
| LogP | 3.71218 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 317.9804 |
| Heavy Atoms | 19 |
| Complexity | 662.1365 |
Chemical Identifiers
| CAS Number | 842115-60-0 |
|---|---|
| SMILES | C1=CC(=CC=C1NC(=O)C2=C(C=C(C=C2)C#N)F)Br |
Product Overview
N-(4-bromophenyl)-4-cyano-2-fluorobenzamide (CAS 842115-60-0), with molecular formula C14H8BrFN2O and molecular weight 317.98 g/mol. IUPAC: N-(4-bromophenyl)-4-cyano-2-fluorobenzamide.
Chemical Property Profile of N-(4-bromophenyl)-4-cyano-2-fluorobenzamide
Property Insights of N-(4-bromophenyl)-4-cyano-2-fluorobenzamide
The XLogP value of 3.71218 indicates that N-(4-bromophenyl)-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-bromophenyl)-4-cyano-2-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-bromophenyl)-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-bromophenyl)-4-cyano-2-fluorobenzamide?
The CAS number of N-(4-bromophenyl)-4-cyano-2-fluorobenzamide is 842115-60-0.
What is the molecular formula of N-(4-bromophenyl)-4-cyano-2-fluorobenzamide?
The molecular formula of N-(4-bromophenyl)-4-cyano-2-fluorobenzamide is C14H8BrFN2O.
What is the molecular weight of N-(4-bromophenyl)-4-cyano-2-fluorobenzamide?
The molecular weight of N-(4-bromophenyl)-4-cyano-2-fluorobenzamide is 317.98 g/mol.
Where can I buy N-(4-bromophenyl)-4-cyano-2-fluorobenzamide?
You can request a quote for N-(4-bromophenyl)-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-bromophenyl)-4-cyano-2-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromophenyl)-4-cyano-2-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.