N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺
TL;DR: N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺 (CAS 26088-79-9) is a chemical compound with molecular formula C12H9N3O and molecular weight 211.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺
N-[4-(2,2-dicyanoethenyl)phenyl]acetamide
Also Known As: N-(4-(2,2-Dicyanovinyl)phenyl)acetamide, 2-(4-Acetamidobenzylidene)malononitrile, Tyrphostin deriv. 3, 4'-(2,2-Dicyanovinyl)acetanilide, N-[4-(2,2-dicyanoethenyl)phenyl]acetamide
| Molecular Formula | C12H9N3O |
|---|---|
| Molecular Weight | 211.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.07455 |
| Heavy Atoms | 16 |
| Complexity | 367.0 |
Chemical Identifiers
| CAS Number | 26088-79-9 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)C=C(C#N)C#N |
| InChIKey | HDJOIOGUBRECCC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺 (CAS 26088-79-9), with molecular formula C12H9N3O and molecular weight 211.07 g/mol. IUPAC: N-[4-(2,2-dicyanoethenyl)phenyl]acetamide.
Chemical Property Profile of N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺
Property Insights of N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺. The TPSA of 76.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺. Following Lipinski's Rule of Five, N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺 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 N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺?
The CAS number of N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺 is 26088-79-9.
What is the molecular formula of N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺?
The molecular formula of N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺 is C12H9N3O.
What is the molecular weight of N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺?
The molecular weight of N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺 is 211.07 g/mol.
Where can I buy N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺?
You can request a quote for N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺?
Yes, KEHONG BIO provides custom synthesis services for N-(4-(2,2-二氰基乙烯基)苯基)乙酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.