3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile
TL;DR: 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile (CAS 338402-91-8) is a chemical compound with molecular formula C15H10Cl2N2O and molecular weight 304.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile
Also Known As: 3-(5-chloro-2-hydroxyanilino)-2-(4-chlorophenyl)acrylonitrile, 3-(5-chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile
| Molecular Formula | C15H10Cl2N2O |
|---|---|
| Molecular Weight | 304.02 g/mol |
| LogP | 4.67558 |
| Topological Polar Surface Area | 56.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.01703 |
| Heavy Atoms | 20 |
| Complexity | 688.00995 |
Chemical Identifiers
| CAS Number | 338402-91-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=CNC2=C(C=CC(=C2)Cl)O)C#N)Cl |
Product Overview
3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile (CAS 338402-91-8), with molecular formula C15H10Cl2N2O and molecular weight 304.02 g/mol. IUPAC: 3-(5-chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile.
Chemical Property Profile of 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile
Property Insights of 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile
The XLogP value of 4.67558 indicates that 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.05 Ų, 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile has 2 hydrogen bond donor(s) and 3 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-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile?
The CAS number of 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile is 338402-91-8.
What is the molecular formula of 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile?
The molecular formula of 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile is C15H10Cl2N2O.
What is the molecular weight of 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile?
The molecular weight of 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile is 304.02 g/mol.
Where can I buy 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile?
You can request a quote for 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-Chloro-2-hydroxyanilino)-2-(4-chlorophenyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.