(2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile
TL;DR: (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile (CAS 142888-28-6) is a chemical compound with molecular formula C18H15N3O and molecular weight 289.12152 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile
Also Known As: AB01321092-02, (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile, (E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile, (E)-2-(1H-benzo[d]imidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile
Technical Specifications
| Molecular Formula | C18H15N3O |
| Molecular Weight | 289.12152 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 61.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.12152 Da |
| Heavy Atoms | 22 |
| Complexity | 470.0 |
| SMILES | C/C(=C(/C#N)\C1=NC2=CC=CC=C2N1)/C3=CC=C(C=C3)OC |
| InChIKey | NIUZRCULMFVJRK-NTCAYCPXSA-N |
Chemical Property Profile of (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile
Property Insights of (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile
The XLogP value of 3.9 indicates that (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile. Following Lipinski's Rule of Five, (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile 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
What is the CAS number of (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile?
The CAS number of (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile is 142888-28-6.
What is the molecular formula of (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile?
The molecular formula of (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile is C18H15N3O.
What is the molecular weight of (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile?
The molecular weight of (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile is 289.12152 g/mol.
Where can I buy (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile?
You can request a quote for (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile?
Yes, CoreyChem provides custom synthesis services for (2E)-2-(1H-benzimidazol-2-yl)-3-(4-methoxyphenyl)but-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.