![3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide structure](/static/products/882/882234-52-8.png)
3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
TL;DR: 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide (CAS 882234-52-8) is a chemical compound with molecular formula C28H16ClF3N4O2 and molecular weight 532.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
Also Known As: 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide, (E)-3-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
| Molecular Formula | C28H16ClF3N4O2 |
|---|---|
| Molecular Weight | 532.09 g/mol |
| LogP | 7.50338 |
| Topological Polar Surface Area | 83.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 532.0914 |
| Heavy Atoms | 38 |
| Complexity | 1697.6669 |
Chemical Identifiers
| CAS Number | 882234-52-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)/C=C(\C#N)/C(=O)NC5=C(C=CC(=C5)C(F)(F)F)Cl |
Product Overview
3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide (CAS 882234-52-8), with molecular formula C28H16ClF3N4O2 and molecular weight 532.09 g/mol. IUPAC: (E)-3-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide.
Chemical Property Profile of 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
Property Insights of 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
The XLogP value of 7.50338 indicates that 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.85 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide. Following Lipinski's Rule of Five, 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide?
The CAS number of 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide is 882234-52-8.
What is the molecular formula of 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide?
The molecular formula of 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide is C28H16ClF3N4O2.
What is the molecular weight of 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide?
The molecular weight of 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide is 532.09 g/mol.
Where can I buy 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide?
You can request a quote for 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)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-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-(1-benzofuran-2-yl)-1-phenyl-1H-pyrazol-4-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.