![(2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide structure](/static/products/340/340302-58-1.png)
(2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide
TL;DR: (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide (CAS 340302-58-1) is a chemical compound with molecular formula C20H18BrIN2O2 and molecular weight 523.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[4-[(4-bromophenyl)methoxy]-3-iodophenyl]-2-cyano-N-propan-2-ylprop-2-enamide
Also Known As: (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide, (E)-3-(4-((4-bromobenzyl)oxy)-3-iodophenyl)-2-cyano-N-isopropylacrylamide, (2E)-3-{4-[(4-bromophenyl)methoxy]-3-iodophenyl}-2-cyano-N-(methylethyl)prop-2 -enamide, (E)-3-[4-[(4-bromophenyl)methoxy]-3-iodophenyl]-2-cyano-N-propan-2-ylprop-2-enamide, 3-[4-[(4-bromophenyl)methoxy]-3-iodo-phenyl]-2-cyano-N-propan-2-yl-prop-2-enamide
| Molecular Formula | C20H18BrIN2O2 |
|---|---|
| Molecular Weight | 523.96 g/mol |
| LogP | 5.06428 |
| Topological Polar Surface Area | 62.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 523.95966 |
| Heavy Atoms | 26 |
| Complexity | 855.10516 |
Chemical Identifiers
| CAS Number | 340302-58-1 |
|---|---|
| SMILES | CC(C)NC(=O)/C(=C/C1=CC(=C(C=C1)OCC2=CC=C(C=C2)Br)I)/C#N |
Product Overview
(2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide (CAS 340302-58-1), with molecular formula C20H18BrIN2O2 and molecular weight 523.96 g/mol. IUPAC: (E)-3-[4-[(4-bromophenyl)methoxy]-3-iodophenyl]-2-cyano-N-propan-2-ylprop-2-enamide.
Chemical Property Profile of (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide
Property Insights of (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide
The XLogP value of 5.06428 indicates that (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.12 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide. Following Lipinski's Rule of Five, (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide?
The CAS number of (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide is 340302-58-1.
What is the molecular formula of (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide?
The molecular formula of (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide is C20H18BrIN2O2.
What is the molecular weight of (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide?
The molecular weight of (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide is 523.96 g/mol.
Where can I buy (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide?
You can request a quote for (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-{4-[(4-bromobenzyl)oxy]-3-iodophenyl}-2-cyano-N-(propan-2-yl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.