3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide
TL;DR: 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide (CAS 200626-23-9) is a chemical compound with molecular formula C14H16N2O and molecular weight 228.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-tert-butylphenyl)-2-cyanoprop-2-enamide
Also Known As: 3-(4-tert-butylphenyl)-2-cyanoprop-2-enamide, 2-Cyano-3-[4-(1,1-dimethylethyl)phenyl]-2-propenamide
| Molecular Formula | C14H16N2O |
|---|---|
| Molecular Weight | 228.13 g/mol |
| LogP | 2.37638 |
| Topological Polar Surface Area | 66.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.12627 |
| Heavy Atoms | 17 |
| Complexity | 484.43887 |
Chemical Identifiers
| CAS Number | 200626-23-9 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C=C(C#N)C(=O)N |
Product Overview
3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide (CAS 200626-23-9), with molecular formula C14H16N2O and molecular weight 228.13 g/mol. IUPAC: 3-(4-tert-butylphenyl)-2-cyanoprop-2-enamide.
Chemical Property Profile of 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide
Property Insights of 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide
The XLogP value of 2.37638 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide. The TPSA of 66.88 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide. Following Lipinski's Rule of Five, 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide has 1 hydrogen bond donor(s) and 2 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 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide?
The CAS number of 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide is 200626-23-9.
What is the molecular formula of 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide?
The molecular formula of 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide is C14H16N2O.
What is the molecular weight of 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide?
The molecular weight of 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide is 228.13 g/mol.
Where can I buy 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide?
You can request a quote for 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Tert-butylphenyl)-2-cyanoprop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.