N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide
TL;DR: N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide (CAS 13257-78-8) is a chemical compound with molecular formula C14H11ClN2O3 and molecular weight 290.0458 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide
Also Known As: N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide, BAS 01879423, N-(3-Chloro-phenyl)-4-methyl-3-nitro-benzamide, N-(3-chlorophenyl)(4-methyl-3-nitrophenyl)carboxamide
Technical Specifications
| Molecular Formula | C14H11ClN2O3 |
| Molecular Weight | 290.0458 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.0458 Da |
| Heavy Atoms | 20 |
| Complexity | 372.0 |
| SMILES | CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)Cl)[N+](=O)[O-] |
| InChIKey | XLAZCOJKKUOINF-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide
Property Insights of N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide
The XLogP value of 3.9 indicates that N-(3-chlorophenyl)-4-methyl-3-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-(3-chlorophenyl)-4-methyl-3-nitrobenzamide. Following Lipinski's Rule of Five, N-(3-chlorophenyl)-4-methyl-3-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-(3-chlorophenyl)-4-methyl-3-nitrobenzamide?
The CAS number of N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide is 13257-78-8.
What is the molecular formula of N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide?
The molecular formula of N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide is C14H11ClN2O3.
What is the molecular weight of N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide?
The molecular weight of N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide is 290.0458 g/mol.
Where can I buy N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide?
You can request a quote for N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide?
Yes, CoreyChem provides custom synthesis services for N-(3-chlorophenyl)-4-methyl-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.