![3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide structure](/static/products/4446/444656-66-0.webp)
3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide
TL;DR: 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide (CAS 444656-66-0) is a chemical compound with molecular formula C17H12BrClN2O2 and molecular weight 389.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[3-bromo-4-[(4-chlorophenyl)methoxy]phenyl]-2-cyanoprop-2-enamide
Also Known As: 3-{3-bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide, (E)-3-[3-bromo-4-[(4-chlorophenyl)methoxy]phenyl]-2-cyanoprop-2-enamide
| Molecular Formula | C17H12BrClN2O2 |
|---|---|
| Molecular Weight | 389.98 g/mol |
| LogP | 4.07378 |
| Topological Polar Surface Area | 76.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 389.97708 |
| Heavy Atoms | 23 |
| Complexity | 795.23096 |
Chemical Identifiers
| CAS Number | 444656-66-0 |
|---|---|
| SMILES | C1=CC(=CC=C1COC2=C(C=C(C=C2)/C=C(\C#N)/C(=O)N)Br)Cl |
Product Overview
3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide (CAS 444656-66-0), with molecular formula C17H12BrClN2O2 and molecular weight 389.98 g/mol. IUPAC: (E)-3-[3-bromo-4-[(4-chlorophenyl)methoxy]phenyl]-2-cyanoprop-2-enamide.
Chemical Property Profile of 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide
Property Insights of 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide
The XLogP value of 4.07378 indicates that 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide. Following Lipinski's Rule of Five, 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide has 1 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-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide?
The CAS number of 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide is 444656-66-0.
What is the molecular formula of 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide?
The molecular formula of 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide is C17H12BrClN2O2.
What is the molecular weight of 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide?
The molecular weight of 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide is 389.98 g/mol.
Where can I buy 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide?
You can request a quote for 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide 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-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 3-{3-Bromo-4-[(4-chlorophenyl)methoxy]phenyl}-2-cyanoprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.