3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide
TL;DR: 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide (CAS 303135-58-2) 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.
3-methyl-N-[(4-methylphenyl)methyl]-4-nitrobenzamide
Also Known As: 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide, 3-methyl-N-[(4-methylphenyl)methyl]-4-nitrobenzamide, (3-methyl-4-nitrophenyl)-N-[(4-methylphenyl)methyl]carboxamide
| 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 | 678.4215 |
Chemical Identifiers
| CAS Number | 303135-58-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])C |
Product Overview
3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide (CAS 303135-58-2), with molecular formula C16H16N2O3 and molecular weight 284.12 g/mol. IUPAC: 3-methyl-N-[(4-methylphenyl)methyl]-4-nitrobenzamide.
Chemical Property Profile of 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide
Property Insights of 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide
The XLogP value of 3.14164 indicates that 3-methyl-N-(4-methylbenzyl)-4-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 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide. Following Lipinski's Rule of Five, 3-methyl-N-(4-methylbenzyl)-4-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 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide?
The CAS number of 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide is 303135-58-2.
What is the molecular formula of 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide?
The molecular formula of 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide is C16H16N2O3.
What is the molecular weight of 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide?
The molecular weight of 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide is 284.12 g/mol.
Where can I buy 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide?
You can request a quote for 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-N-(4-methylbenzyl)-4-nitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.