(Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide
TL;DR: (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide (CAS 383892-75-9) is a chemical compound with molecular formula C22H16ClFN4O4 and molecular weight 454.08 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-(2-methoxyphenyl)prop-2-enamide
Also Known As: (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide, (Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yl)oxy-3-methoxyphenyl]-2-cyano-N-(2-methoxyphenyl)prop-2-enamide
| Molecular Formula | C22H16ClFN4O4 |
|---|---|
| Molecular Weight | 454.08 g/mol |
| LogP | 4.62428 |
| Topological Polar Surface Area | 106.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 454.0844 |
| Heavy Atoms | 32 |
| Complexity | 1226.793 |
Chemical Identifiers
| CAS Number | 383892-75-9 |
|---|---|
| SMILES | COC1=CC=CC=C1NC(=O)/C(=C\C2=CC(=C(C=C2)OC3=NC(=NC=C3F)Cl)OC)/C#N |
Product Overview
(Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide (CAS 383892-75-9), with molecular formula C22H16ClFN4O4 and molecular weight 454.08 g/mol. IUPAC: (Z)-3-[4-(2-chloro-5-fluoropyrimidin-4-yl)oxy-3-methoxyphenyl]-2-cyano-N-(2-methoxyphenyl)prop-2-enamide.
Chemical Property Profile of (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide
Property Insights of (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide
The XLogP value of 4.62428 indicates that (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.36 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide. Following Lipinski's Rule of Five, (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide has 1 hydrogen bond donor(s) and 7 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 (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide?
The CAS number of (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide is 383892-75-9.
What is the molecular formula of (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide?
The molecular formula of (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide is C22H16ClFN4O4.
What is the molecular weight of (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide?
The molecular weight of (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide is 454.08 g/mol.
Where can I buy (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide?
You can request a quote for (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for (Z)-3-(4-((2-chloro-5-fluoropyrimidin-4-yl)oxy)-3-methoxyphenyl)-2-cyano-N-(2-methoxyphenyl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.