(E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide
TL;DR: (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide (CAS 957047-81-3) is a chemical compound with molecular formula C24H20N4O2 and molecular weight 396.16 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-(2-cyanoethyl)pyrazol-4-yl]-N-benzylprop-2-enamide
Also Known As: F1683-1643, (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide, (E)-3-[3-(1-benzofuran-2-yl)-1-(2-cyanoethyl)pyrazol-4-yl]-N-benzylprop-2-enamide
| Molecular Formula | C24H20N4O2 |
|---|---|
| Molecular Weight | 396.16 g/mol |
| LogP | 4.53958 |
| Topological Polar Surface Area | 83.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 396.15863 |
| Heavy Atoms | 30 |
| Complexity | 1196.0698 |
Chemical Identifiers
| CAS Number | 957047-81-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)/C=C/C2=CN(N=C2C3=CC4=CC=CC=C4O3)CCC#N |
Product Overview
(E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide (CAS 957047-81-3), with molecular formula C24H20N4O2 and molecular weight 396.16 g/mol. IUPAC: (E)-3-[3-(1-benzofuran-2-yl)-1-(2-cyanoethyl)pyrazol-4-yl]-N-benzylprop-2-enamide.
Chemical Property Profile of (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide
Property Insights of (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide
The XLogP value of 4.53958 indicates that (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide 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 (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide. Following Lipinski's Rule of Five, (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide 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 (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide?
The CAS number of (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide is 957047-81-3.
What is the molecular formula of (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide?
The molecular formula of (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide is C24H20N4O2.
What is the molecular weight of (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide?
The molecular weight of (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide is 396.16 g/mol.
Where can I buy (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide?
You can request a quote for (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(3-(benzofuran-2-yl)-1-(2-cyanoethyl)-1H-pyrazol-4-yl)-N-benzylacrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.