3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide
TL;DR: 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide (CAS 541516-95-4) is a chemical compound with molecular formula C16H13FN2O3 and molecular weight 300.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide
Also Known As: 3-(4-fluorophenyl)-N-{3-nitro-4-methylphenyl}acrylamide, 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide
| Molecular Formula | C16H13FN2O3 |
|---|---|
| Molecular Weight | 300.09 g/mol |
| LogP | 3.69422 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.09103 |
| Heavy Atoms | 22 |
| Complexity | 739.55615 |
Chemical Identifiers
| CAS Number | 541516-95-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC(=O)C=CC2=CC=C(C=C2)F)[N+](=O)[O-] |
Product Overview
3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide (CAS 541516-95-4), with molecular formula C16H13FN2O3 and molecular weight 300.09 g/mol. IUPAC: 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide.
Chemical Property Profile of 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide
Property Insights of 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide
The XLogP value of 3.69422 indicates that 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide. Following Lipinski's Rule of Five, 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide 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 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide?
The CAS number of 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide is 541516-95-4.
What is the molecular formula of 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide?
The molecular formula of 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide is C16H13FN2O3.
What is the molecular weight of 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide?
The molecular weight of 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide is 300.09 g/mol.
Where can I buy 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide?
You can request a quote for 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-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-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-fluorophenyl)-N-(4-methyl-3-nitrophenyl)prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.