![N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide structure](/static/products/876/876899-95-5.png)
N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide
TL;DR: N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide (CAS 876899-95-5) is a chemical compound with molecular formula C19H18ClFN4O and molecular weight 372.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide
Also Known As: BAS 11781211, N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide, N-(3-chloro-4-(4-methylpiperazin-1-yl)phenyl)-4-cyano-2-fluorobenzamide, N-[3-Chloro-4-(4-methyl-piperazin-1-yl)-phenyl]-4-cyano-2-fluoro-benzamide
| Molecular Formula | C19H18ClFN4O |
|---|---|
| Molecular Weight | 372.12 g/mol |
| LogP | 3.35488 |
| Topological Polar Surface Area | 59.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.11533 |
| Heavy Atoms | 26 |
| Complexity | 872.32825 |
Chemical Identifiers
| CAS Number | 876899-95-5 |
|---|---|
| SMILES | CN1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=C(C=C(C=C3)C#N)F)Cl |
Product Overview
N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide (CAS 876899-95-5), with molecular formula C19H18ClFN4O and molecular weight 372.12 g/mol. IUPAC: N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide.
Chemical Property Profile of N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide
Property Insights of N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide
The XLogP value of 3.35488 indicates that N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-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 59.37 Ų, N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-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-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide?
The CAS number of N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide is 876899-95-5.
What is the molecular formula of N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide?
The molecular formula of N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide is C19H18ClFN4O.
What is the molecular weight of N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide?
The molecular weight of N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide is 372.12 g/mol.
Where can I buy N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide?
You can request a quote for N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-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-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-cyano-2-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.