![3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide structure](/static/products/3031/303153-06-2.webp)
3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide
TL;DR: 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide (CAS 303153-06-2) is a chemical compound with molecular formula C17H12ClF3N4O2 and molecular weight 396.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]anilino]-2-cyanobut-2-enamide
Also Known As: 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide, (2E)-3-[(4-{[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxy}phenyl)amino]-2-cyanobut-2-enamide, 11H-934, (E)-3-[4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]oxyanilino]-2-cyanobut-2-enamide, (E)-3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]oxy]anilino]-2-cyano-but-2-enamide
| Molecular Formula | C17H12ClF3N4O2 |
|---|---|
| Molecular Weight | 396.06 g/mol |
| LogP | 4.24088 |
| Topological Polar Surface Area | 101.03 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.0601 |
| Heavy Atoms | 27 |
| Complexity | 934.6752 |
Chemical Identifiers
| CAS Number | 303153-06-2 |
|---|---|
| SMILES | C/C(=C(/C#N)\C(=O)N)/NC1=CC=C(C=C1)OC2=C(C=C(C=N2)C(F)(F)F)Cl |
Product Overview
3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide (CAS 303153-06-2), with molecular formula C17H12ClF3N4O2 and molecular weight 396.06 g/mol. IUPAC: (E)-3-[4-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy]anilino]-2-cyanobut-2-enamide.
Chemical Property Profile of 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide
Property Insights of 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide
The XLogP value of 4.24088 indicates that 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide. Following Lipinski's Rule of Five, 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide 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-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide?
The CAS number of 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide is 303153-06-2.
What is the molecular formula of 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide?
The molecular formula of 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide is C17H12ClF3N4O2.
What is the molecular weight of 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide?
The molecular weight of 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide is 396.06 g/mol.
Where can I buy 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide?
You can request a quote for 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-{[3-chloro-5-(trifluoromethyl)-2-pyridinyl]oxy}anilino)-2-cyano-2-butenamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.