(2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile
TL;DR: (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile (CAS 1593958-64-5) is a chemical compound with molecular formula C16H12N4 and molecular weight 260.11 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-pyridin-4-ylprop-2-enenitrile
Also Known As: BAS 00557300, (E)-2-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylprop-2-enenitrile, 2-(1-methyl-1H-benzimidazol-2-yl)-3-(4-pyridinyl)acrylonitrile, (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile, (E)-2-(1-methyl-1H-benzo[d]imidazol-2-yl)-3-(pyridin-4-yl)acrylonitrile
| Molecular Formula | C16H12N4 |
|---|---|
| Molecular Weight | 260.11 g/mol |
| LogP | 3.03248 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.1062 |
| Heavy Atoms | 20 |
| Complexity | 822.5542 |
Chemical Identifiers
| CAS Number | 1593958-64-5 |
|---|---|
| SMILES | CN1C2=CC=CC=C2N=C1/C(=C/C3=CC=NC=C3)/C#N |
Product Overview
(2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile (CAS 1593958-64-5), with molecular formula C16H12N4 and molecular weight 260.11 g/mol. IUPAC: (E)-2-(1-methylbenzimidazol-2-yl)-3-pyridin-4-ylprop-2-enenitrile.
Chemical Property Profile of (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile
Property Insights of (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile
The XLogP value of 3.03248 indicates that (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.5 Ų, (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile has 0 hydrogen bond donor(s) and 3 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 (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile?
The CAS number of (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile is 1593958-64-5.
What is the molecular formula of (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile?
The molecular formula of (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile is C16H12N4.
What is the molecular weight of (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile?
The molecular weight of (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile is 260.11 g/mol.
Where can I buy (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile?
You can request a quote for (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for (2E)-2-(1-methylbenzimidazol-2-yl)-3-(4-pyridyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.