(E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide
TL;DR: (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide (CAS 383370-40-9) is a chemical compound with molecular formula C27H28N4O3 and molecular weight 456.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-cyano-3-[3-(4-ethoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]-N-(oxolan-2-ylmethyl)prop-2-enamide
Also Known As: (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide, (E)-2-cyano-3-[3-(4-ethoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]-N-(oxolan-2-ylmethyl)prop-2-enamide, 2-cyano-3-[3-(4-ethoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]-N-(oxolan-2-ylmethyl)prop-2-enamide
| Molecular Formula | C27H28N4O3 |
|---|---|
| Molecular Weight | 456.22 g/mol |
| LogP | 4.4486 |
| Topological Polar Surface Area | 89.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 456.21616 |
| Heavy Atoms | 34 |
| Complexity | 1218.4174 |
Chemical Identifiers
| CAS Number | 383370-40-9 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C(=O)NCC3CCCO3)C4=CC=CC=C4)C |
Product Overview
(E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide (CAS 383370-40-9), with molecular formula C27H28N4O3 and molecular weight 456.22 g/mol. IUPAC: (E)-2-cyano-3-[3-(4-ethoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]-N-(oxolan-2-ylmethyl)prop-2-enamide.
Chemical Property Profile of (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide
Property Insights of (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide
The XLogP value of 4.4486 indicates that (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.17 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide. Following Lipinski's Rule of Five, (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide has 1 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 (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide?
The CAS number of (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide is 383370-40-9.
What is the molecular formula of (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide?
The molecular formula of (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide is C27H28N4O3.
What is the molecular weight of (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide?
The molecular weight of (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide is 456.22 g/mol.
Where can I buy (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide?
You can request a quote for (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-cyano-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-N-((tetrahydrofuran-2-yl)methyl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.