4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide
TL;DR: 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide (CAS 335420-47-8) is a chemical compound with molecular formula C17H17FN2O4 and molecular weight 332.11725 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide
Also Known As: ETHANOL-2-D1, 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide, 4-butoxy-N-{4-fluoro-3-nitrophenyl}benzamide, BAS 02243132, 4-Butoxy-N-(4-fluoro-3-nitro-phenyl)-benzamide
Technical Specifications
| Molecular Formula | C17H17FN2O4 |
| Molecular Weight | 332.11725 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 84.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 332.11725 Da |
| Heavy Atoms | 24 |
| Complexity | 421.0 |
| SMILES | CCCCOC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-] |
| InChIKey | MEEIGYBGFZBQQR-UHFFFAOYSA-N |
Chemical Property Profile of 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide
Property Insights of 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide
The XLogP value of 3.9 indicates that 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide. Following Lipinski's Rule of Five, 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide?
The CAS number of 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide is 335420-47-8.
What is the molecular formula of 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide?
The molecular formula of 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide is C17H17FN2O4.
What is the molecular weight of 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide?
The molecular weight of 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide is 332.11725 g/mol.
Where can I buy 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide?
You can request a quote for 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide?
Yes, CoreyChem provides custom synthesis services for 4-butoxy-N-(4-fluoro-3-nitrophenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.