![2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide structure](/static/products/101/1013218-65-9.png)
2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide
TL;DR: 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide (CAS 1013218-65-9) is a chemical compound with molecular formula C13H12F2N2O3 and molecular weight 282.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide
Also Known As: 2-cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide, (E)-2-cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide
| Molecular Formula | C13H12F2N2O3 |
|---|---|
| Molecular Weight | 282.08 g/mol |
| LogP | 2.07898 |
| Topological Polar Surface Area | 85.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 282.0816 |
| Heavy Atoms | 20 |
| Complexity | 565.225 |
Chemical Identifiers
| CAS Number | 1013218-65-9 |
|---|---|
| SMILES | CCOC1=CC=CC(=C1OC(F)F)/C=C(\C#N)/C(=O)N |
Product Overview
2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide (CAS 1013218-65-9), with molecular formula C13H12F2N2O3 and molecular weight 282.08 g/mol. IUPAC: (E)-2-cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide.
Chemical Property Profile of 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide
Property Insights of 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide
The XLogP value of 2.07898 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide. The TPSA of 85.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide. Following Lipinski's Rule of Five, 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide has 1 hydrogen bond donor(s) and 4 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 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide?
The CAS number of 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide is 1013218-65-9.
What is the molecular formula of 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide?
The molecular formula of 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide is C13H12F2N2O3.
What is the molecular weight of 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide?
The molecular weight of 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide is 282.08 g/mol.
Where can I buy 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide?
You can request a quote for 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]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 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Cyano-3-[2-(difluoromethoxy)-3-ethoxyphenyl]prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.