3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide
TL;DR: 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide (CAS 5730-14-3) is a chemical compound with molecular formula C19H17BrN2O4 and molecular weight 416.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide
Also Known As: 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide, (Z)-3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide, 3-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide
| Molecular Formula | C19H17BrN2O4 |
|---|---|
| Molecular Weight | 416.04 g/mol |
| LogP | 4.10768 |
| Topological Polar Surface Area | 91.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 416.03717 |
| Heavy Atoms | 26 |
| Complexity | 870.34326 |
Chemical Identifiers
| CAS Number | 5730-14-3 |
|---|---|
| SMILES | CCOC1=C(C(=CC(=C1)/C=C(/C#N)\C(=O)NC2=CC=C(C=C2)OC)Br)O |
Product Overview
3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide (CAS 5730-14-3), with molecular formula C19H17BrN2O4 and molecular weight 416.04 g/mol. IUPAC: (Z)-3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)prop-2-enamide.
Chemical Property Profile of 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide
Property Insights of 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide
The XLogP value of 4.10768 indicates that 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide. Following Lipinski's Rule of Five, 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide has 2 hydrogen bond donor(s) and 5 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-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide?
The CAS number of 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide is 5730-14-3.
What is the molecular formula of 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide?
The molecular formula of 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide is C19H17BrN2O4.
What is the molecular weight of 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide?
The molecular weight of 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide is 416.04 g/mol.
Where can I buy 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide?
You can request a quote for 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-bromo-5-ethoxy-4-hydroxyphenyl)-2-cyano-N-(4-methoxyphenyl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.