2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide
TL;DR: 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide (CAS 335212-24-3) is a chemical compound with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-[(2-methylphenyl)methyl]-3-nitrobenzamide
Also Known As: 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide, 3-nitro-2-methyl-N-(2-methylbenzyl)benzamide, BAS 02810941, 2-Methyl-N-(2-methyl-benzyl)-3-nitro-benzamide, 2-methyl-N-[(2-methylphenyl)methyl]-3-nitrobenzamide
| Molecular Formula | C16H16N2O3 |
|---|---|
| Molecular Weight | 284.12 g/mol |
| LogP | 3.14164 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.1161 |
| Heavy Atoms | 21 |
| Complexity | 695.6715 |
Chemical Identifiers
| CAS Number | 335212-24-3 |
|---|---|
| SMILES | CC1=CC=CC=C1CNC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C |
Product Overview
2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide (CAS 335212-24-3), with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol. IUPAC: 2-methyl-N-[(2-methylphenyl)methyl]-3-nitrobenzamide.
Chemical Property Profile of 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide
Property Insights of 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide
The XLogP value of 3.14164 indicates that 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide 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 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide. Following Lipinski's Rule of Five, 2-methyl-N-(2-methylbenzyl)-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
Frequently Asked Questions
What is the CAS number of 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide?
The CAS number of 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide is 335212-24-3.
What is the molecular formula of 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide?
The molecular formula of 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide is C16H16N2O3.
What is the molecular weight of 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide?
The molecular weight of 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide is 284.12 g/mol.
Where can I buy 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide?
You can request a quote for 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 2-methyl-N-(2-methylbenzyl)-3-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.