![N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide structure](/static/products/876/876899-22-8.png)
N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide
TL;DR: N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide (CAS 876899-22-8) is a chemical compound with molecular formula C20H18ClFN4O2 and molecular weight 400.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide
Also Known As: BAS 11781117, AP-970/43375704, N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide, N-[4-(4-acetyl-1-piperazinyl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide, N-[4-(4-Acetyl-piperazin-1-yl)-3-chloro-phenyl]-4-cyano-2-fluoro-benzamide
| Molecular Formula | C20H18ClFN4O2 |
|---|---|
| Molecular Weight | 400.11 g/mol |
| LogP | 3.27158 |
| Topological Polar Surface Area | 76.44 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 400.11023 |
| Heavy Atoms | 28 |
| Complexity | 965.16345 |
Chemical Identifiers
| CAS Number | 876899-22-8 |
|---|---|
| SMILES | CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=C(C=C3)C#N)F)Cl |
Product Overview
N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide (CAS 876899-22-8), with molecular formula C20H18ClFN4O2 and molecular weight 400.11 g/mol. IUPAC: N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide.
Chemical Property Profile of N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide
Property Insights of N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide
The XLogP value of 3.27158 indicates that N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.44 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide. Following Lipinski's Rule of Five, N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide has 1 hydrogen bond donor(s) and 4 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-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide?
The CAS number of N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide is 876899-22-8.
What is the molecular formula of N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide?
The molecular formula of N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide is C20H18ClFN4O2.
What is the molecular weight of N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide?
The molecular weight of N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide is 400.11 g/mol.
Where can I buy N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide?
You can request a quote for N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-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-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(4-acetylpiperazin-1-yl)-3-chlorophenyl]-4-cyano-2-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.