N-(4-Butylphenyl)-2-nitrobenzamide
TL;DR: N-(4-Butylphenyl)-2-nitrobenzamide (CAS 120275-55-0) is a chemical compound with molecular formula C17H18N2O3 and molecular weight 298.13174 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(4-butylphenyl)-2-nitrobenzamide
Also Known As: N-(4-butylphenyl)-2-nitrobenzamide
Technical Specifications
| Molecular Formula | C17H18N2O3 |
| Molecular Weight | 298.13174 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 298.13174 Da |
| Heavy Atoms | 22 |
| Complexity | 373.0 |
| SMILES | CCCCC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2[N+](=O)[O-] |
| InChIKey | KRVQVYBHIFTKDT-UHFFFAOYSA-N |
Chemical Property Profile of N-(4-Butylphenyl)-2-nitrobenzamide
Property Insights of N-(4-Butylphenyl)-2-nitrobenzamide
The XLogP value of 3.6 indicates that N-(4-Butylphenyl)-2-nitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-Butylphenyl)-2-nitrobenzamide. Following Lipinski's Rule of Five, N-(4-Butylphenyl)-2-nitrobenzamide 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
What is the CAS number of N-(4-Butylphenyl)-2-nitrobenzamide?
The CAS number of N-(4-Butylphenyl)-2-nitrobenzamide is 120275-55-0.
What is the molecular formula of N-(4-Butylphenyl)-2-nitrobenzamide?
The molecular formula of N-(4-Butylphenyl)-2-nitrobenzamide is C17H18N2O3.
What is the molecular weight of N-(4-Butylphenyl)-2-nitrobenzamide?
The molecular weight of N-(4-Butylphenyl)-2-nitrobenzamide is 298.13174 g/mol.
Where can I buy N-(4-Butylphenyl)-2-nitrobenzamide?
You can request a quote for N-(4-Butylphenyl)-2-nitrobenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-Butylphenyl)-2-nitrobenzamide?
Yes, CoreyChem provides custom synthesis services for N-(4-Butylphenyl)-2-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.