![N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide structure](/static/products/873/87310-69-8.png)
N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide
TL;DR: N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide (CAS 87310-69-8) is a chemical compound with molecular formula C11H7F3N2O2 and molecular weight 256.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide
Also Known As: N-[4-CYANO-3-(TRIFLUOROMETHYL)PHENYL]-2-OXOPROPANAMIDE, J1.748.318H, N-(4-Cyano-3-trifluoromethyl-phenyl]-2-oxo-propionamide, N-[4-cyano-3-(trifluoromethyl)phenyl]-2-oxo-propanamide, N-(4-cyano-3-(trifluoromethyl)phenyl)-2-oxo propanamide
| Molecular Formula | C11H7F3N2O2 |
|---|---|
| Molecular Weight | 256.05 g/mol |
| LogP | 2.10458 |
| Topological Polar Surface Area | 69.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.04596 |
| Heavy Atoms | 18 |
| Complexity | 544.1998 |
Chemical Identifiers
| CAS Number | 87310-69-8 |
|---|---|
| SMILES | CC(=O)C(=O)NC1=CC(=C(C=C1)C#N)C(F)(F)F |
Product Overview
N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide (CAS 87310-69-8), with molecular formula C11H7F3N2O2 and molecular weight 256.05 g/mol. IUPAC: N-[4-cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide.
Chemical Property Profile of N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide
Property Insights of N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide
The XLogP value of 2.10458 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide. The TPSA of 69.96 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide. Following Lipinski's Rule of Five, N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide 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-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide?
The CAS number of N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide is 87310-69-8.
What is the molecular formula of N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide?
The molecular formula of N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide is C11H7F3N2O2.
What is the molecular weight of N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide?
The molecular weight of N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide is 256.05 g/mol.
Where can I buy N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide?
You can request a quote for N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-Cyano-3-(trifluoromethyl)phenyl]-2-oxopropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.