N-(2-Chlorobenzylidene)-4-acetylaniline
TL;DR: N-(2-Chlorobenzylidene)-4-acetylaniline (CAS 86553-27-7) is a chemical compound with molecular formula C15H12ClNO and molecular weight 257.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[(2-chlorophenyl)methylideneamino]phenyl]ethanone
Also Known As: N-(2-Chlorobenzylidene)-4-acetylaniline, 2-benzothienylquinoline, N- -4-ACETYLANILINE&, KST-1B8946, 4-Acetyl-N-(2-chlorobenzylidene)aniline
| Molecular Formula | C15H12ClNO |
|---|---|
| Molecular Weight | 257.06 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 29.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 257.06073 |
| Heavy Atoms | 18 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 86553-27-7 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)N=CC2=CC=CC=C2Cl |
| InChIKey | WVYAARLSLNKEHT-UHFFFAOYSA-N |
Product Overview
N-(2-Chlorobenzylidene)-4-acetylaniline (CAS 86553-27-7), with molecular formula C15H12ClNO and molecular weight 257.06 g/mol. IUPAC: 1-[4-[(2-chlorophenyl)methylideneamino]phenyl]ethanone.
Chemical Property Profile of N-(2-Chlorobenzylidene)-4-acetylaniline
Property Insights of N-(2-Chlorobenzylidene)-4-acetylaniline
The XLogP value of 3.5 indicates that N-(2-Chlorobenzylidene)-4-acetylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.4 Ų, N-(2-Chlorobenzylidene)-4-acetylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Chlorobenzylidene)-4-acetylaniline has 0 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-(2-Chlorobenzylidene)-4-acetylaniline?
The CAS number of N-(2-Chlorobenzylidene)-4-acetylaniline is 86553-27-7.
What is the molecular formula of N-(2-Chlorobenzylidene)-4-acetylaniline?
The molecular formula of N-(2-Chlorobenzylidene)-4-acetylaniline is C15H12ClNO.
What is the molecular weight of N-(2-Chlorobenzylidene)-4-acetylaniline?
The molecular weight of N-(2-Chlorobenzylidene)-4-acetylaniline is 257.06 g/mol.
Where can I buy N-(2-Chlorobenzylidene)-4-acetylaniline?
You can request a quote for N-(2-Chlorobenzylidene)-4-acetylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Chlorobenzylidene)-4-acetylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Chlorobenzylidene)-4-acetylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.