N-(2,6-Dimethylphenyl)-3-nitrobenzamide
TL;DR: N-(2,6-Dimethylphenyl)-3-nitrobenzamide (CAS 102631-06-1) is a chemical compound with molecular formula C15H14N2O3 and molecular weight 270.10043 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2,6-dimethylphenyl)-3-nitrobenzamide
Also Known As: N-(2,6-dimethylphenyl)-3-nitrobenzamide, 3-NITROBENZO-2',6'-XYLIDIDE, BIM-0047930.P001, N-(2,6-dimethylphenyl)(3-nitrophenyl)carboxamide, 666-026-5
Technical Specifications
| Molecular Formula | C15H14N2O3 |
| Molecular Weight | 270.10043 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 74.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.10043 Da |
| Heavy Atoms | 20 |
| Complexity | 357.0 |
| SMILES | CC1=C(C(=CC=C1)C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-] |
| InChIKey | REVIHAXJENUXBF-UHFFFAOYSA-N |
Chemical Property Profile of N-(2,6-Dimethylphenyl)-3-nitrobenzamide
Property Insights of N-(2,6-Dimethylphenyl)-3-nitrobenzamide
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,6-Dimethylphenyl)-3-nitrobenzamide. The TPSA of 74.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,6-Dimethylphenyl)-3-nitrobenzamide. Following Lipinski's Rule of Five, N-(2,6-Dimethylphenyl)-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-(2,6-Dimethylphenyl)-3-nitrobenzamide?
The CAS number of N-(2,6-Dimethylphenyl)-3-nitrobenzamide is 102631-06-1.
What is the molecular formula of N-(2,6-Dimethylphenyl)-3-nitrobenzamide?
The molecular formula of N-(2,6-Dimethylphenyl)-3-nitrobenzamide is C15H14N2O3.
What is the molecular weight of N-(2,6-Dimethylphenyl)-3-nitrobenzamide?
The molecular weight of N-(2,6-Dimethylphenyl)-3-nitrobenzamide is 270.10043 g/mol.
Where can I buy N-(2,6-Dimethylphenyl)-3-nitrobenzamide?
You can request a quote for N-(2,6-Dimethylphenyl)-3-nitrobenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2,6-Dimethylphenyl)-3-nitrobenzamide?
Yes, CoreyChem provides custom synthesis services for N-(2,6-Dimethylphenyl)-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.