(E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile
TL;DR: (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile (CAS 371132-22-8) is a chemical compound with molecular formula C29H25N5O and molecular weight 459.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[3-(4-ethoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile
Also Known As: (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile, (E)-3-[3-(4-ethoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile
| Molecular Formula | C29H25N5O |
|---|---|
| Molecular Weight | 459.21 g/mol |
| LogP | 6.1973 |
| Topological Polar Surface Area | 68.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 459.2059 |
| Heavy Atoms | 35 |
| Complexity | 1584.9327 |
Chemical Identifiers
| CAS Number | 371132-22-8 |
|---|---|
| SMILES | CCOC1=C(C=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C3=NC4=CC=CC=C4N3C)C5=CC=CC=C5)C |
Product Overview
(E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile (CAS 371132-22-8), with molecular formula C29H25N5O and molecular weight 459.21 g/mol. IUPAC: (E)-3-[3-(4-ethoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]-2-(1-methylbenzimidazol-2-yl)prop-2-enenitrile.
Chemical Property Profile of (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile
Property Insights of (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile
The XLogP value of 6.1973 indicates that (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.66 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile. Following Lipinski's Rule of Five, (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile has 0 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 (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile?
The CAS number of (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile is 371132-22-8.
What is the molecular formula of (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile?
The molecular formula of (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile is C29H25N5O.
What is the molecular weight of (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile?
The molecular weight of (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile is 459.21 g/mol.
Where can I buy (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile?
You can request a quote for (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile 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-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(3-(4-ethoxy-3-methylphenyl)-1-phenyl-1H-pyrazol-4-yl)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.