3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile
TL;DR: 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile (CAS 338402-93-0) is a chemical compound with molecular formula C15H10Cl2N2 and molecular weight 288.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chloroanilino)-2-(4-chlorophenyl)prop-2-enenitrile
Also Known As: Bionet2_000271, 3-(4-chloroanilino)-2-(4-chlorophenyl)acrylonitrile, 3-(4-chloroanilino)-2-(4-chlorophenyl)prop-2-enenitrile, 2-(4-chlorophenyl)-3-[(4-chlorophenyl)amino]prop-2-enenitrile
| Molecular Formula | C15H10Cl2N2 |
|---|---|
| Molecular Weight | 288.02 g/mol |
| LogP | 4.96998 |
| Topological Polar Surface Area | 35.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 288.0221 |
| Heavy Atoms | 19 |
| Complexity | 622.6903 |
Chemical Identifiers
| CAS Number | 338402-93-0 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=CNC2=CC=C(C=C2)Cl)C#N)Cl |
Product Overview
3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile (CAS 338402-93-0), with molecular formula C15H10Cl2N2 and molecular weight 288.02 g/mol. IUPAC: 3-(4-chloroanilino)-2-(4-chlorophenyl)prop-2-enenitrile.
Chemical Property Profile of 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile
Property Insights of 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile
The XLogP value of 4.96998 indicates that 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.82 Ų, 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile 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 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile?
The CAS number of 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile is 338402-93-0.
What is the molecular formula of 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile?
The molecular formula of 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile is C15H10Cl2N2.
What is the molecular weight of 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile?
The molecular weight of 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile is 288.02 g/mol.
Where can I buy 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile?
You can request a quote for 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chloroanilino)-2-(4-chlorophenyl)acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.