![N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide structure](/static/products/4248/424801-55-8.webp)
N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide
TL;DR: N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide (CAS 424801-55-8) is a chemical compound with molecular formula C15H13ClFN3O3 and molecular weight 337.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(4-chloro-2-nitroanilino)ethyl]-4-fluorobenzamide
Also Known As: BIM-0043092.P001, N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide, N-{2-[(4-chloro-2-nitrophenyl)amino]ethyl}-4-fluorobenzamide, A2729/0115865, N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide #
| Molecular Formula | C15H13ClFN3O3 |
|---|---|
| Molecular Weight | 337.06 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.06296 |
| Heavy Atoms | 23 |
| Complexity | 413.0 |
Chemical Identifiers
| CAS Number | 424801-55-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)NCCNC2=C(C=C(C=C2)Cl)[N+](=O)[O-])F |
| InChIKey | HXDLGZDSNOZGQD-UHFFFAOYSA-N |
Product Overview
N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide (CAS 424801-55-8), with molecular formula C15H13ClFN3O3 and molecular weight 337.06 g/mol. IUPAC: N-[2-(4-chloro-2-nitroanilino)ethyl]-4-fluorobenzamide.
Chemical Property Profile of N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide
Property Insights of N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide
The XLogP value of 4.0 indicates that N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide. Following Lipinski's Rule of Five, N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide has 2 hydrogen bond donor(s) and 5 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-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide?
The CAS number of N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide is 424801-55-8.
What is the molecular formula of N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide?
The molecular formula of N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide is C15H13ClFN3O3.
What is the molecular weight of N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide?
The molecular weight of N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide is 337.06 g/mol.
Where can I buy N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide?
You can request a quote for N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(4-Chloro-2-nitroanilino)ethyl]-4-fluorobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.