![(2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide structure](/static/products/116/1164528-02-2.png)
(2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide
TL;DR: (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide (CAS 1164528-02-2) is a chemical compound with molecular formula C22H16ClFN4O3 and molecular weight 438.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yl)oxy-3-methoxyphenyl]-2-cyano-N-(4-methylphenyl)prop-2-enamide
Also Known As: (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide, (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(p-tolyl)acrylamide, (Z)-3-[4-(2-Chloro-5-fluoro-pyrimidin-4-yloxy)-3-methoxy-phenyl]-2-cyano-N-p-tolyl-acrylamide, (Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yl)oxy-3-methoxyphenyl]-2-cyano-N-(4-methylphenyl)prop-2-enamide
| Molecular Formula | C22H16ClFN4O3 |
|---|---|
| Molecular Weight | 438.09 g/mol |
| LogP | 4.9241 |
| Topological Polar Surface Area | 97.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 438.0895 |
| Heavy Atoms | 31 |
| Complexity | 1190.3507 |
Chemical Identifiers
| CAS Number | 1164528-02-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)/C(=C\C2=CC(=C(C=C2)OC3=NC(=NC=C3F)Cl)OC)/C#N |
Product Overview
(2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide (CAS 1164528-02-2), with molecular formula C22H16ClFN4O3 and molecular weight 438.09 g/mol. IUPAC: (Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yl)oxy-3-methoxyphenyl]-2-cyano-N-(4-methylphenyl)prop-2-enamide.
Chemical Property Profile of (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide
Property Insights of (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide
The XLogP value of 4.9241 indicates that (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.13 Ų falls within the moderate polarity range, balancing permeability and solubility for (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide. Following Lipinski's Rule of Five, (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide has 1 hydrogen bond donor(s) and 6 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 (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide?
The CAS number of (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide is 1164528-02-2.
What is the molecular formula of (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide?
The molecular formula of (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide is C22H16ClFN4O3.
What is the molecular weight of (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide?
The molecular weight of (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide is 438.09 g/mol.
Where can I buy (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide?
You can request a quote for (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)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 (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yloxy)-3-methoxyphenyl]-2-cyano-N-(4-m ethylphenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.