2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile
TL;DR: 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile (CAS 57319-72-9) is a chemical compound with molecular formula C14H9N3O and molecular weight 235.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-yl)-3-(furan-2-yl)prop-2-enenitrile
Also Known As: UPCMLD0ENAT5686666:001, BAS 01949241, (2E)-2-(1H-Benzimidazol-2-yl)-3-(2-furyl)acrylonitrile, 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile, alpha-(2-Furanylmethylene)-1H-benzimidazole-2-acetonitrile
| Molecular Formula | C14H9N3O |
|---|---|
| Molecular Weight | 235.07 g/mol |
| LogP | 3.22008 |
| Topological Polar Surface Area | 65.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.07455 |
| Heavy Atoms | 18 |
| Complexity | 711.791 |
Chemical Identifiers
| CAS Number | 57319-72-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)C(=CC3=CC=CO3)C#N |
Product Overview
2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile (CAS 57319-72-9), with molecular formula C14H9N3O and molecular weight 235.07 g/mol. IUPAC: 2-(1H-benzimidazol-2-yl)-3-(furan-2-yl)prop-2-enenitrile.
Chemical Property Profile of 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile
Property Insights of 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile
The XLogP value of 3.22008 indicates that 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.61 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile. Following Lipinski's Rule of Five, 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile has 1 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 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile?
The CAS number of 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile is 57319-72-9.
What is the molecular formula of 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile?
The molecular formula of 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile is C14H9N3O.
What is the molecular weight of 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile?
The molecular weight of 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile is 235.07 g/mol.
Where can I buy 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile?
You can request a quote for 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-benzimidazol-2-yl)-3-(2-furanyl)-2-propenenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.