(E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile
TL;DR: (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile (CAS 702647-32-3) is a chemical compound with molecular formula C16H10BrCl2NO and molecular weight 380.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile
Also Known As: (2E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile, (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile
| Molecular Formula | C16H10BrCl2NO |
|---|---|
| Molecular Weight | 380.93 g/mol |
| LogP | 5.82868 |
| Topological Polar Surface Area | 33.02 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 380.93228 |
| Heavy Atoms | 21 |
| Complexity | 709.92755 |
Chemical Identifiers
| CAS Number | 702647-32-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1Br)/C=C(/C#N)\C2=CC=C(C=C2)Cl)Cl |
Product Overview
(E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile (CAS 702647-32-3), with molecular formula C16H10BrCl2NO and molecular weight 380.93 g/mol. IUPAC: (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile.
Chemical Property Profile of (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile
Property Insights of (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile
The XLogP value of 5.82868 indicates that (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-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 33.02 Ų, (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile?
The CAS number of (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile is 702647-32-3.
What is the molecular formula of (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile?
The molecular formula of (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile is C16H10BrCl2NO.
What is the molecular weight of (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile?
The molecular weight of (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile is 380.93 g/mol.
Where can I buy (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile?
You can request a quote for (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-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 (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(3-bromo-5-chloro-4-methoxyphenyl)-2-(4-chlorophenyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.