![(E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile structure](/static/products/313/313405-82-2.png)
(E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile
TL;DR: (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile (CAS 313405-82-2) is a chemical compound with molecular formula C17H12N4O2 and molecular weight 304.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-2-(1-methylbenzimidazol-2-yl)-3-(2-nitrophenyl)prop-2-enenitrile
Also Known As: F0327-0164, (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile, (2E)-2-(1-methyl-1H-1,3-benzodiazol-2-yl)-3-(2-nitrophenyl)prop-2-enenitrile, (E)-2-(1-methylbenzimidazol-2-yl)-3-(2-nitrophenyl)prop-2-enenitrile, (E)-2-(1-methyl-1H-1,3-benzimidazol-2-yl)-3-(o-nitrophenyl)acrylonitrile
| Molecular Formula | C17H12N4O2 |
|---|---|
| Molecular Weight | 304.10 g/mol |
| LogP | 3.54568 |
| Topological Polar Surface Area | 84.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.09604 |
| Heavy Atoms | 23 |
| Complexity | 979.6672 |
Chemical Identifiers
| CAS Number | 313405-82-2 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1/C(=C/C3=CC=CC=C3[N+](=O)[O-])/C#N |
Product Overview
(E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile (CAS 313405-82-2), with molecular formula C17H12N4O2 and molecular weight 304.10 g/mol. IUPAC: (E)-2-(1-methylbenzimidazol-2-yl)-3-(2-nitrophenyl)prop-2-enenitrile.
Chemical Property Profile of (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile
Property Insights of (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile
The XLogP value of 3.54568 indicates that (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.75 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile. Following Lipinski's Rule of Five, (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile has 0 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)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile?
The CAS number of (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile is 313405-82-2.
What is the molecular formula of (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile?
The molecular formula of (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile is C17H12N4O2.
What is the molecular weight of (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile?
The molecular weight of (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile is 304.10 g/mol.
Where can I buy (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile?
You can request a quote for (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile?
Yes, KEHONG BIO provides custom synthesis services for (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(2-nitrophenyl)acrylonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.